CHEBI:214632 - Gymnodrimane B

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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 Gymnodrimane B
ChEBI ID CHEBI:214632
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H24O5
Net Charge 0
Average Mass 296.363
Monoisotopic Mass 296.16237
InChI InChI=1S/C16H24O5/c1-15(2)11-5-4-9(13(18)19)10-8-21-14(20-3)16(10,11)7-6-12(15)17/h4,10-12,14,17H,5-8H2,1-3H3,(H,18,19)/t10-,11-,12-,14-,16-/m0/s1
InChIKey VNSNUUUFNWTZOA-HNRKBYSSSA-N
SMILES O=C(O)C1=CC[C@H]2C([C@@H](O)CC[C@@]32[C@H]1CO[C@@H]3OC)(C)C
Metabolite of Species Details
Gymnopilus (NCBI:txid86085) See: DOI
ChEBI Ontology
Outgoing Gymnodrimane B (CHEBI:214632) is a naphthofuran (CHEBI:39270)
IUPAC Name
(1S,3aR,6aS,8S,10aR)-8-hydroxy-1-methoxy-7,7-dimethyl-1,3,3a,6,6a,8,9,10-octahydrobenzo[d][2]benzouran-4-carboxylic acid