Test
CAS: 9005-79-2 Molecular Formula: C24H42O21 Molecular Weight (g/mol): 666.58 InChI Key: BYSGBSNPRWKUQH-UJDJLXLFSA-N IUPAC Name: (2S,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-4,5-dihydroxy-6-{[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol SMILES: OC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
CAS | 9005-79-2 |
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Molecular Weight (g/mol) | 666.58 |
SMILES | OC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O |
IUPAC Name | (2S,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-4,5-dihydroxy-6-{[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol |
InChI Key | BYSGBSNPRWKUQH-UJDJLXLFSA-N |
Molecular Formula | C24H42O21 |
CAS: 56-81-5 Molecular Formula: C3H8O3 Molecular Weight (g/mol): 92.09 MDL Number: MFCD00004722 InChI Key: PEDCQBHIVMGVHV-UHFFFAOYSA-N IUPAC Name: propane-1,2,3-triol SMILES: OCC(O)CO
CAS | 56-81-5 |
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Molecular Weight (g/mol) | 92.09 |
MDL Number | MFCD00004722 |
SMILES | OCC(O)CO |
IUPAC Name | propane-1,2,3-triol |
InChI Key | PEDCQBHIVMGVHV-UHFFFAOYSA-N |
Molecular Formula | C3H8O3 |
CAS: 69-65-8 Molecular Formula: C6H14O6 Molecular Weight (g/mol): 182.17 MDL Number: MFCD00064287 InChI Key: FBPFZTCFMRRESA-UHFFFAOYNA-N IUPAC Name: hexane-1,2,3,4,5,6-hexol SMILES: OCC(O)C(O)C(O)C(O)CO
CAS | 69-65-8 |
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Molecular Weight (g/mol) | 182.17 |
MDL Number | MFCD00064287 |
SMILES | OCC(O)C(O)C(O)C(O)CO |
IUPAC Name | hexane-1,2,3,4,5,6-hexol |
InChI Key | FBPFZTCFMRRESA-UHFFFAOYNA-N |
Molecular Formula | C6H14O6 |
CAS: 6284-40-8 Molecular Formula: C7H17NO5 Molecular Weight (g/mol): 195.22 InChI Key: MBBZMMPHUWSWHV-UHFFFAOYNA-N IUPAC Name: 6-(methylamino)hexane-1,2,3,4,5-pentol SMILES: CNCC(O)C(O)C(O)C(O)CO
CAS | 6284-40-8 |
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Molecular Weight (g/mol) | 195.22 |
SMILES | CNCC(O)C(O)C(O)C(O)CO |
IUPAC Name | 6-(methylamino)hexane-1,2,3,4,5-pentol |
InChI Key | MBBZMMPHUWSWHV-UHFFFAOYNA-N |
Molecular Formula | C7H17NO5 |
CAS: 56-81-5 Molecular Formula: C3H8O3 Molecular Weight (g/mol): 92.09 MDL Number: MFCD00004722 InChI Key: PEDCQBHIVMGVHV-UHFFFAOYSA-N IUPAC Name: propane-1,2,3-triol SMILES: OCC(O)CO
CAS | 56-81-5 |
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Molecular Weight (g/mol) | 92.09 |
MDL Number | MFCD00004722 |
SMILES | OCC(O)CO |
IUPAC Name | propane-1,2,3-triol |
InChI Key | PEDCQBHIVMGVHV-UHFFFAOYSA-N |
Molecular Formula | C3H8O3 |
CAS: 5989-81-1 Molecular Formula: C12H24O12 Molecular Weight (g/mol): 360.31 InChI Key: WSVLPVUVIUVCRA-KPKNDVKVSA-N IUPAC Name: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-{[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-3,4,5-triol hydrate SMILES: O.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
CAS | 5989-81-1 |
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Molecular Weight (g/mol) | 360.31 |
SMILES | O.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |
IUPAC Name | (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-{[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-3,4,5-triol hydrate |
InChI Key | WSVLPVUVIUVCRA-KPKNDVKVSA-N |
Molecular Formula | C12H24O12 |
CAS: 50-99-7 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 InChI Key: WQZGKKKJIJFFOK-UHFFFAOYNA-N IUPAC Name: 6-(hydroxymethyl)oxane-2,3,4,5-tetrol SMILES: OCC1OC(O)C(O)C(O)C1O
CAS | 50-99-7 |
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Molecular Weight (g/mol) | 180.16 |
SMILES | OCC1OC(O)C(O)C(O)C1O |
IUPAC Name | 6-(hydroxymethyl)oxane-2,3,4,5-tetrol |
InChI Key | WQZGKKKJIJFFOK-UHFFFAOYNA-N |
Molecular Formula | C6H12O6 |
CAS: 9005-32-7 Molecular Formula: (C6H8O7)A(C6H8O7)B SMILES: O[C@H]1[C@@H](O)[C@H](O-*)[C@H](O[C@H]1O-*)C(O)=O.O[C@H]1[C@@H](O)[C@H](O-*)[C@@H](O[C@H]1O-*)C(O)=O
CAS | 9005-32-7 |
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SMILES | O[C@H]1[C@@H](O)[C@H](O-*)[C@H](O[C@H]1O-*)C(O)=O.O[C@H]1[C@@H](O)[C@H](O-*)[C@@H](O[C@H]1O-*)C(O)=O |
Molecular Formula | (C6H8O7)A(C6H8O7)B |
CAS: 5965-66-2 Molecular Formula: C12H22O11 Molecular Weight (g/mol): 342.30 MDL Number: MFCD00064521 InChI Key: GUBGYTABKSRVRQ-DCSYEGIMSA-N IUPAC Name: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-{[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-3,4,5-triol SMILES: OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O
CAS | 5965-66-2 |
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Molecular Weight (g/mol) | 342.30 |
MDL Number | MFCD00064521 |
SMILES | OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O |
IUPAC Name | (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-{[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}oxane-3,4,5-triol |
InChI Key | GUBGYTABKSRVRQ-DCSYEGIMSA-N |
Molecular Formula | C12H22O11 |
CAS: 9004-32-4 Molecular Formula: (C12 H14 O9 R6)n Molecular Weight (g/mol): 263.20 MDL Number: MFCD00081472 InChI Key: DPXJVFZANSGRMM-UHFFFAOYNA-N IUPAC Name: 2,3,4,5,6-pentahydroxyhexanal acetic acid sodium SMILES: [Na].CC(O)=O.OCC(O)C(O)C(O)C(O)C=O
CAS | 9004-32-4 |
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Molecular Weight (g/mol) | 263.20 |
MDL Number | MFCD00081472 |
SMILES | [Na].CC(O)=O.OCC(O)C(O)C(O)C(O)C=O |
IUPAC Name | 2,3,4,5,6-pentahydroxyhexanal acetic acid sodium |
InChI Key | DPXJVFZANSGRMM-UHFFFAOYNA-N |
Molecular Formula | (C12 H14 O9 R6)n |
CAS: 9004-62-0 Molecular Formula: C29H52O21 Molecular Weight (g/mol): 736.71 InChI Key: CWSZBVAUYPTXTG-UHFFFAOYNA-N IUPAC Name: 5-{[6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}methyl)-3,4-dihydroxy-5-{[4-hydroxy-3-(2-hydroxyethoxy)-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}oxan-2-yl]oxy}-6-(hydroxymethyl)-2-methyloxane-3,4-diol SMILES: COC1C(O)C(O)C(OCC2OC(OC3C(O)C(O)C(C)OC3CO)C(O)C(O)C2OC2OC(CO)C(OC)C(O)C2OCCO)OC1CO
CAS | 9004-62-0 |
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Molecular Weight (g/mol) | 736.71 |
SMILES | COC1C(O)C(O)C(OCC2OC(OC3C(O)C(O)C(C)OC3CO)C(O)C(O)C2OC2OC(CO)C(OC)C(O)C2OCCO)OC1CO |
IUPAC Name | 5-{[6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}methyl)-3,4-dihydroxy-5-{[4-hydroxy-3-(2-hydroxyethoxy)-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}oxan-2-yl]oxy}-6-(hydroxymethyl)-2-methyloxane-3,4-diol |
InChI Key | CWSZBVAUYPTXTG-UHFFFAOYNA-N |
Molecular Formula | C29H52O21 |
CAS: 9004-67-5 Molecular Formula: C20H38O11 Molecular Weight (g/mol): 454.51 InChI Key: YLGXILFCIXHCMC-UHFFFAOYNA-N IUPAC Name: 3,4,5-trimethoxy-2-(methoxymethyl)-6-{[4,5,6-trimethoxy-2-(methoxymethyl)oxan-3-yl]oxy}oxane SMILES: COCC1OC(OC2C(COC)OC(OC)C(OC)C2OC)C(OC)C(OC)C1OC
CAS | 9004-67-5 |
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Molecular Weight (g/mol) | 454.51 |
SMILES | COCC1OC(OC2C(COC)OC(OC)C(OC)C2OC)C(OC)C(OC)C1OC |
IUPAC Name | 3,4,5-trimethoxy-2-(methoxymethyl)-6-{[4,5,6-trimethoxy-2-(methoxymethyl)oxan-3-yl]oxy}oxane |
InChI Key | YLGXILFCIXHCMC-UHFFFAOYNA-N |
Molecular Formula | C20H38O11 |
CAS: 9012-76-4 Molecular Formula: C56H103N9O39 Molecular Weight (g/mol): 1526.46 InChI Key: FLASNYPZGWUPSU-SICDJOISSA-N IUPAC Name: methyl N-[(2S,3R,4R,5S,6R)-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-{[(2R,3S,4R,5R,6S)-5-amino-6-{[(2R,3S,4R,5R,6R)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]carbamate SMILES: COC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7N)[C@H](O)[C@H]6N)[C@H](O)[C@H]5N)[C@H](O)[C@H]4N)[C@H](O)[C@H]3N)[C@H](O)[C@H]2N)[C@@H](CO)O[C@H]1O[C@H]1[C@H](O)[C@@H](N)[C@H](O[C@H]2[C@H](O)[C@@H](N)[C@H](O)O[C@@H]2CO)O[C@@H]1CO
CAS | 9012-76-4 |
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Molecular Weight (g/mol) | 1526.46 |
SMILES | COC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7N)[C@H](O)[C@H]6N)[C@H](O)[C@H]5N)[C@H](O)[C@H]4N)[C@H](O)[C@H]3N)[C@H](O)[C@H]2N)[C@@H](CO)O[C@H]1O[C@H]1[C@H](O)[C@@H](N)[C@H](O[C@H]2[C@H](O)[C@@H](N)[C@H](O)O[C@@H]2CO)O[C@@H]1CO |
IUPAC Name | methyl N-[(2S,3R,4R,5S,6R)-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-5-{[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-{[(2R,3S,4R,5R,6S)-5-amino-6-{[(2R,3S,4R,5R,6R)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]carbamate |
InChI Key | FLASNYPZGWUPSU-SICDJOISSA-N |
Molecular Formula | C56H103N9O39 |
CAS: 9004-62-0 Molecular Formula: C29H52O21 Molecular Weight (g/mol): 736.71 InChI Key: CWSZBVAUYPTXTG-UHFFFAOYNA-N IUPAC Name: 5-{[6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}methyl)-3,4-dihydroxy-5-{[4-hydroxy-3-(2-hydroxyethoxy)-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}oxan-2-yl]oxy}-6-(hydroxymethyl)-2-methyloxane-3,4-diol SMILES: COC1C(O)C(O)C(OCC2OC(OC3C(O)C(O)C(C)OC3CO)C(O)C(O)C2OC2OC(CO)C(OC)C(O)C2OCCO)OC1CO
CAS | 9004-62-0 |
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Molecular Weight (g/mol) | 736.71 |
SMILES | COC1C(O)C(O)C(OCC2OC(OC3C(O)C(O)C(C)OC3CO)C(O)C(O)C2OC2OC(CO)C(OC)C(O)C2OCCO)OC1CO |
IUPAC Name | 5-{[6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}methyl)-3,4-dihydroxy-5-{[4-hydroxy-3-(2-hydroxyethoxy)-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}oxan-2-yl]oxy}-6-(hydroxymethyl)-2-methyloxane-3,4-diol |
InChI Key | CWSZBVAUYPTXTG-UHFFFAOYNA-N |
Molecular Formula | C29H52O21 |
CAS: 50-70-4 Molecular Formula: C6H14O6 Molecular Weight (g/mol): 182.17 InChI Key: FBPFZTCFMRRESA-UHFFFAOYNA-N IUPAC Name: hexane-1,2,3,4,5,6-hexol SMILES: OCC(O)C(O)C(O)C(O)CO
CAS | 50-70-4 |
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Molecular Weight (g/mol) | 182.17 |
SMILES | OCC(O)C(O)C(O)C(O)CO |
IUPAC Name | hexane-1,2,3,4,5,6-hexol |
InChI Key | FBPFZTCFMRRESA-UHFFFAOYNA-N |
Molecular Formula | C6H14O6 |