CHEBI:216333 - Fornicatin F

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Fornicatin F
ChEBI ID CHEBI:216333
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C29H44O6
Net Charge 0
Average Mass 488.665
Monoisotopic Mass 488.31379
InChI InChI=1S/C29H44O6/c1-17(2)20-15-21(30)26-25(27(20,4)13-12-24(33)35-8)22(31)16-29(6)19(11-14-28(26,29)5)18(3)9-10-23(32)34-7/h18-21,30H,1,9-16H2,2-8H3/t18-,19-,20?,21+,27+,28+,29-/m1/s1
InChIKey UGJXEHKMCJXGAZ-YGXBQKDFSA-N
SMILES O=C1C2=C([C@@]3(CC[C@@H]([C@]3(C1)C)[C@@H](CCC(=O)OC)C)C)[C@@H](O)CC([C@@]2(CCC(=O)OC)C)C(=C)C
Metabolite of Species Details
Ganoderma (NCBI:txid5314) See: PubMed
ChEBI Ontology
Outgoing Fornicatin F (CHEBI:216333) is a diterpenoid (CHEBI:23849)
IUPAC Name
methyl (4R)-4-[(3R,3aR,6S,9S,9bR)-9-hydroxy-6-(3-methoxy-3-oxopropyl)-3a,6,9b-trimethyl-5-oxo-7-prop-1-en-2-yl-2,3,4,7,8,9-hexahydro-1H-cyclopenta[a]naphthalen-3-yl]pentanoate
Manual Xref Database
78441348 ChemSpider
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