Hispidulin acetate
Basic information
- CAS
1178-23-0- Standard SMILES
COc1c(OC(C)=O)cc2oc(-c3ccc(OC(C)=O)cc3)cc(=O)c2c1OC(C)=O- InChIKey
HIOZFEXHRPPNDN-UHFFFAOYSA-N- Molecular formula
- C22H18O9
- Average molar mass
- 426.4 g/mol
- Monoisotopic mass
- 426.09508215
Overview
Hispidulin acetate is an ether and a member of flavonoids.
Names & identifiers
- Preferred name
- Hispidulin acetate
- IUPAC
- [4-(5,7-diacetyloxy-6-methoxy-4-oxochromen-2-yl)phenyl] acetate
Names & synonyms
Hispidulin acetate1178-23-0RefChem:347823CHEBI:177065DTXSID101346666[4-(5,7-diacetyloxy-6-methoxy-4-oxochromen-2-yl)phenyl] acetateQ63408663
Database identifiers
- CAS
1178-23-0- PubChem CID
- 5322009
- DTXSID
DTXSID101346666- ChEBI
CHEBI:177065
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 750
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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