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Basic information
- CAS
63999-06-4- Standard SMILES
CC1OC(CC(=O)O)Cc2c(O)c3c(c(O)c21)C(=O)C1=C(C3=O)C2CC(O)C1(O)C(C)O2- InChIKey
GNTIHWMOJLHUNA-UHFFFAOYSA-N- Molecular formula
- C22H22O10
- Average molar mass
- 446.408 g/mol
- Monoisotopic mass
- 446.1212969
Names & identifiers
- Preferred name
- [5,9,10,12-Tetrahydroxy-1,13-dimethyl-6,11-dioxo-3,4,6,7,8,9,10,11-octahydro-1H-7,10-(epoxymethano)anthra[2,3-c]pyran-3-yl]acetic acid
- IUPAC
- [5,9,10,12-Tetrahydroxy-1,13-dimethyl-6,11-dioxo-3,4,6,7,8,9,10,11-octahydro-1H-7,10-(epoxymethano)anthra[2,3-c]pyran-3-yl]acetic acid
Database identifiers
- CAS
63999-06-4- PubChem CID
- 162191
- DTXSID
DTXSID60981902
Related reactions
0 records
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Compound notes
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