CHEBI:195996 - 3-Copaene-2-ol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 3-Copaene-2-ol
ChEBI ID CHEBI:195996
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H24O
Net Charge 0
Average Mass 220.356
Monoisotopic Mass 220.18272
InChI InChI=1S/C15H24O/c1-8(2)10-5-6-15(4)13-9(3)7-11(16)14(15)12(10)13/h7-8,10-14,16H,5-6H2,1-4H3/t10-,11+,12-,13?,14+,15?/m1/s1
InChIKey LTXWSWWXNHYXCW-SHBJXTLMSA-N
SMILES O[C@@H]1[C@@]2(C3(C([C@]2([C@H](CC3)C(C)C)[H])C(=C1)C)C)[H]
ChEBI Ontology
Outgoing 3-Copaene-2-ol (CHEBI:195996) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(2S,3S,7R,8R)-1,5-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-4-en-3-ol
Manual Xref Database
24846754 ChemSpider
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