Tephrosia candida, from
Basic information
- CAS
58942-17-9- Standard SMILES
COc1ccc(-c2oc3cc(OC4OC(C)C(O)C(O)C4O)c(O)c(O)c3c(=O)c2OC2OC(C)C(O)C(O)C2O)cc1- InChIKey
NFBWQYZCQAVTLM-UHFFFAOYSA-N- Molecular formula
- C28H32O15
- Average molar mass
- 608.5 g/mol
- Monoisotopic mass
- 608.17412031
Names & identifiers
- Preferred name
- Tephrosia candida, from
- IUPAC
- 5,6-dihydroxy-2-(4-methoxyphenyl)-3,7-bis[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]chromen-4-one
Names & synonyms
NSC29184258942-17-9TEPHROSIA CANDIDA, FROMDTXSID70315077NSC-2918423-[(6-Deoxyhexopyranosyl)oxy]-5,6-dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 6-deoxyhexopyranoside
Database identifiers
- CAS
58942-17-9- PubChem CID
- 324874
- DTXSID
DTXSID70315077
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 234 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 6
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 1,020
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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