CHEBI:203502 - Drimenol ester 6a

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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 Drimenol ester 6a
ChEBI ID CHEBI:203502
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C31H56O2
Net Charge 0
Average Mass 460.787
Monoisotopic Mass 460.42803
InChI InChI=1S/C31H56O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-20-29(32)33-25-27-26(2)21-22-28-30(3,4)23-19-24-31(27,28)5/h21,27-28H,6-20,22-25H2,1-5H3/t27-,28?,31+/m0/s1
InChIKey BWVORMIFCYNAQK-NNNMJZHGSA-N
SMILES O=C(OC[C@H]1C(=CCC2[C@@]1(CCCC2(C)C)C)C)CCCCCCCCCCCCCCC
Metabolite of Species Details
Lactarius uvidus (NCBI:txid152949) See: PubMed
ChEBI Ontology
Outgoing Drimenol ester 6a (CHEBI:203502) is a fatty acid ester (CHEBI:35748)
IUPAC Name
[(1S,8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl hexadecanoate
Manual Xref Database
78441901 ChemSpider
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