Basic information
- Standard SMILES
Cc1cc(C)c(/C=C2\C(=O)N(C(=O)OCC3OC(O)[C@H](O)[C@@H](O)[C@H]3O)c3ccccc32)[nH]1- InChIKey
GGFMOBJERYKTBQ-BLGJNOSCSA-N- Molecular formula
- C22H24N2O8
- Average molar mass
- 444.4 g/mol
Names & identifiers
- Preferred name
- 3-[1-(3,5-Dimethyl-1h-pyrrol-2-yl)-meth-(z)-ylidene]-2-oxo-2,3-dihydro-indole-1-carboxylic acid (3r, 4s, 5r)-3,4,5,6-tetrahydroxy-tetrahydro-pyran-2-ylmethyl ester
- IUPAC
- [(3R,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl (3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxoindole-1-carboxylate
Names & synonyms
GGFMOBJERYKTBQ-BLGJNOSCSA-N3-[1-(3,5-dimethyl-1h-pyrrol-2-yl)-meth-(z)-ylidene]-2-oxo-2,3-dihydro-indole-1-carboxylic acid (3r, 4s, 5r)-3,4,5,6-tetrahydroxy-tetrahydro-pyran-2-ylmethyl ester3-[1-(3,5-dimethyl-1h-pyrrol-2-yl)-meth-(z)-ylidene]-2-oxo-2,3-dihydro-indole-1-carboxylic acid (3r,4s,5r)-3,4,5,6-tetrahydroxy-tetrahydro-pyran-2-ylmethyl ester
Database identifiers
- PubChem CID
- 60111234
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 760
Related reactions
2 records
Compound notes
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