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Basic information
- Standard SMILES
CCCc1cc(=O)oc2c3c(cc(OC(C)COC)c12)O[C@H](C)[C@@H](C)[C@@H]3O- InChIKey
KODLQGVSZMWEAR-MPYVSPAUSA-N- Molecular formula
- C21H28O6
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.18858861
Names & identifiers
- Preferred name
- (8R,9S,10S)-10-hydroxy-5-(1-methoxypropan-2-yloxy)-8,9-dimethyl-4-propyl-9,10-dihydro-8H-pyrano[2,3-h]chromen-2-one
- IUPAC
- (8R,9S,10S)-10-hydroxy-5-(1-methoxypropan-2-yloxy)-8,9-dimethyl-4-propyl-9,10-dihydro-8H-pyrano[2,3-h]chromen-2-one
Names & synonyms
NSC687950NSC-68795010-Hydroxy-5-(2-methoxy-1-methyl-ethoxy) -8,10-trans- dihydro-8H-pyrano[2,3-f]chromen-2-one
Database identifiers
- PubChem CID
- 390510
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 561
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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