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CHEBI:176846 - germacra-1(10),5-dien-4β-ol

ChEBI IDCHEBI:176846
ChEBI Namegermacra-1(10),5-dien-4β-ol
Stars
ASCII Namegermacra-1(10),5-dien-4beta-ol
DefinitionA 1(10),5-germacradien-4-ol in which the hydroxy group has S-configuration
Last Modified16 July 2021
SubmitterAdnan
DownloadsMolfile
FormulaC15H26O
Net Charge0
Average Mass222.372
Monoisotopic Mass222.19837
SMILESC/C1=C\CC[C@](C)(O)/C=C/[C@H](C(C)C)CC1
InChIInChI=1S/C15H26O/c1-12(2)14-8-7-13(3)6-5-10-15(4,16)11-9-14/h6,9,11-12,14,16H,5,7-8,10H2,1-4H3/b11-9+,13-6+/t14-,15+/m1/s1
InChIKeyRHCTXHCNRLCYBN-LDKNCKFKSA-N
Species of MetaboliteComponentSourceComments
Senecio phonolithicus (IPNI:246906-1) - DOI (10.1055/s-2002-32970)
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
ChEBI Ontology
Outgoing Relation(s)
germacra-1(10),5-dien-4β-ol (CHEBI:176846) has role plant metabolite (CHEBI:76924)
germacra-1(10),5-dien-4β-ol (CHEBI:176846) is a 1(10),5-germacradien-4-ol (CHEBI:172933)
IUPAC Name 
(1S,2E,4S,7E)-1,7-dimethyl-4-(propan-2-yl)cyclodeca-2,7-dien-1-ol
Synonyms  Source
cis-1,7-dimethyl-4-isopropyl-2,7-cyclodeca-2(E),7(E)-dien-1-olChEBI
(−)-1(10),5-germacradien-4-olChEBI
(4S,7S)-1(10),5-germacradien-4-olChEBI
(1S,2E,4S,7E)-4-isopropyl-1,7-dimethylcyclodeca-2,7-dien-1-olChEBI
(−)-germacra-1(10),5(E)-dien-4β-olChEBI