CHEBI:210827 - Trichobisabolin D

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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 Trichobisabolin D
ChEBI ID CHEBI:210827
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H28O3
Net Charge 0
Average Mass 268.397
Monoisotopic Mass 268.20384
InChI InChI=1S/C16H28O3/c1-12(6-5-7-13(2)19-14(3)17)15-8-10-16(4,18)11-9-15/h8,10,12-13,15,18H,5-7,9,11H2,1-4H3/t12-,13?,15+,16-/m1/s1
InChIKey VDIBVWMHMSHSRS-RRZQYYKNSA-N
SMILES O=C(OC(CCC[C@H]([C@H]1C=C[C@](O)(C)CC1)C)C)C
Metabolite of Species Details
Trichoderma (NCBI:txid5543) See: PubMed
ChEBI Ontology
Outgoing Trichobisabolin D (CHEBI:210827) is a p-menthane monoterpenoid (CHEBI:25186)
IUPAC Name
[(6R)-6-[(1S,4S)-4-hydroxy-4-methylcyclohex-2-en-1-yl]heptan-2-yl] acetate
Manual Xref Database
77001457 ChemSpider
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