CHEBI:216327 - L-735,334

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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 L-735,334
ChEBI ID CHEBI:216327
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C33H58O4
Net Charge 0
Average Mass 518.823
Monoisotopic Mass 518.43351
InChI InChI=1S/C33H58O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31(35)37-26-28-21-22-29-32(4,24-23-28)25-30(34)33(29,36)27(2)3/h12-13,23,27,29-30,34,36H,5-11,14-22,24-26H2,1-4H3/b13-12-/t29-,30+,32+,33-/m1/s1
InChIKey IRNSDAKENNBILA-JLIQMYDASA-N
SMILES O=C(OCC1=CC[C@]2(C[C@H](O)[C@@]([C@@H]2CC1)(O)C(C)C)C)CCCCCCC/C=C\CCCCCCCC
Metabolite of Species Details
Trichoderma virens (NCBI:txid29875) See: DOI
ChEBI Ontology
Outgoing L-735,334 (CHEBI:216327) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
[(2S,3R,3aR,8aS)-2,3-dihydroxy-8a-methyl-3-propan-2-yl-1,2,3a,4,5,8-hexahydroazulen-6-yl]methyl (Z)-octadec-9-enoate
Manual Xref Database
7982428 ChemSpider
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