Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C15H18O6
- Molecular weight
- 294.3 g/mol
- IUPAC name
- (1S,2R,3S,5R,6R,7R,8S,9R,12R)-2,8-dihydroxy-7-methyl-12-prop-1-en-2-ylspiro[4,10-dioxatetracyclo[7.2.1.02,7.03,5]dodecane-6,2'-oxirane]-11-one
- SMILES
- CC(=C)[C@@H]1[C@@H]2[C@H]([C@]3([C@@]4(CO4)[C@H]5[C@@H]([C@]3([C@H]1C(=O)O2)O)O5)C)O
- InChIKey
- CCAZWUJBLXKBAY-ULZPOIKGSA-N
- XLogP
- -0.5
- Polar surface area
- 91.8 Ų
- H-bond donors
- 2
- H-bond acceptors
- 6
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Mass
- 294.11
Show 4 more facts
- canonical SMILES
- CC(=C)C1C2C(C3(C4(CO4)C5C(C3(C1C(=O)O2)O)O5)C)O
- found in taxon
- Picrodendron baccatum
- chemical formula
- C₁₅H₁₈O₆
- isomeric SMILES
- CC(=C)[C@@H]1[C@@H]2[C@H]([C@]3([C@@]4(CO4)[C@H]5[C@@H]([C@]3([C@H]1C(=O)O2)O)O5)C)O
via Wikidata · CC0