CHEBI:64281 - sclarene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name sclarene
Definition A diterpene that consists of a labdane skeleton with double bonds at C-8(17), C-13(16) and C-14.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C20H32
Net Charge 0
Average Mass 272.46810
Monoisotopic Mass 272.25040
InChI InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m0/s1
SMILES [H][C@]1(CCC(=C)C=C)C(=C)CC[C@@]2([H])C(C)(C)CCC[C@]12C
ChEBI Ontology
Outgoing sclarene (CHEBI:64281) has parent hydride labdane (CHEBI:36505)
sclarene (CHEBI:64281) is a diterpene (CHEBI:35190)
Synonyms Sources
(+)-sclarene ChEBI
Δ8,17.13,16.14-labdatriene ChEBI
labda-8(17),13(16),14-triene ChEBI
sclarene UniProt
Manual Xref Database
CPD-14025 MetaCyc
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Registry Numbers Types Sources
2523112 Reaxys Registry Number Reaxys
511-02-4 CAS Registry Number Reaxys
Citations Waiting for Citations Types Sources
10793256 PubMed citation Europe PMC
12710734 PubMed citation Europe PMC
20397107 PubMed citation Europe PMC
21404436 PubMed citation Europe PMC
IND43636008 Agricola citation Europe PMC
Last Modified
26 March 2012