Caohuoside D
Basic information
- Standard SMILES
COc1ccc(-c2oc3c(CCC(C)(C)OC)c(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)cc(O)c3c(=O)c2O)cc1- InChIKey
IINPFAXRBBMPBJ-BCNKTGMKSA-N- Molecular formula
- C28H34O12
- Average molar mass
- 562.6 g/mol
- Monoisotopic mass
- 562.20502652
Names & identifiers
- Preferred name
- Caohuoside D
- IUPAC
- 3,5-dihydroxy-8-(3-methoxy-3-methylbutyl)-2-(4-methoxyphenyl)-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Names & synonyms
Caohuoside D8-(3''-Hydroxy-3''-methylbutyl)kaempferol 4'-methyl ether 7-glucosideDTXSID801383924
Database identifiers
- PubChem CID
- 44259082
- DTXSID
DTXSID801383924
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 185 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 9
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 900
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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