CHEBI:207222 - Nigrosirpexin A

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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 Nigrosirpexin A
ChEBI ID CHEBI:207222
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H24O3
Net Charge 0
Average Mass 252.354
Monoisotopic Mass 252.17254
InChI InChI=1S/C15H24O3/c1-8-4-12(16)13-11(7-18-14(13)17)10-6-15(2,3)5-9(8)10/h8-9,12-14,16-17H,4-7H2,1-3H3/t8-,9-,12+,13+,14+/m0/s1
InChIKey KVVXWIGSXBNYJY-PWHOCRISSA-N
SMILES O1[C@@H](O)[C@H]2[C@H](O)C[C@H](C)[C@H]3C(=C2C1)CC(C)(C)C3
Metabolite of Species Details
Nigrospora oryzae (NCBI:txid335854) See: PubMed
ChEBI Ontology
Outgoing Nigrosirpexin A (CHEBI:207222) is a oxolanes (CHEBI:26912)
IUPAC Name
(3R,3aR,4R,6S,6aS)-6,8,8-trimethyl-3,3a,4,5,6,6a,7,9-octahydro-1H-azuleno[4,5-c]uran-3,4-diol