Structure via PubChem · Public domain (PubChem)
In the Vinony graph
Vinony's link graph records 9 inbound references to (-)-gambogic acid, and connects out to mass density, digital object identifier and chemical formula.
It is catalogued under topics including Carboxylic acids, Chemical articles with multiple compound IDs and Chemical articles with multiple PubChem CIDs.
Vinony links it to 5 Wikipedia language editions.
Chemical data
- Formula
- C38H44O8
- Molecular weight
- 628.7 g/mol
- IUPAC name
- (Z)-4-[(1S,2S,8R,17S,19R)-12-hydroxy-8,21,21-trimethyl-5-(3-methylbut-2-enyl)-8-(4-methylpent-3-enyl)-14,18-dioxo-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11,15-pentaen-19-yl]-2-methylbut-2-enoic acid
- SMILES
- CC(=CCC[C@@]1(C=CC2=C(C3=C(C(=C2O1)CC=C(C)C)O[C@@]45[C@H]6C[C@@H](C=C4C3=O)C(=O)[C@@]5(OC6(C)C)C/C=C(/C)\C(=O)O)O)C)C
- InChIKey
- GEZHEQNLKAOMCA-RRZNCOCZSA-N
- XLogP
- 7.3
- Polar surface area
- 119 Ų
- H-bond donors
- 2
- H-bond acceptors
- 8
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Mass
- 628.303618368
Show 4 more facts
- canonical SMILES
- CC(=CCCC1(C=CC2=C(O1)C(=C3C(=C2O)C(=O)C4=CC5CC6C4(O3)C(C5=O)(OC6(C)C)CC=C(C)C(=O)O)CC=C(C)C)C)C
- chemical formula
- C₃₈H₄₄O₈
- isomeric SMILES
- CC(=CCC[C@@]1(C=CC2=C(O1)C(=C3C(=C2O)C(=O)C4=C[C@@H]5C[C@@H]6[C@@]4(O3)[C@](C5=O)(OC6(C)C)C/C=C(/C)\C(=O)O)CC=C(C)C)C)C
- found in taxon
- Garcinia cowa
via Wikidata · CC0
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