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CHEBI:138167 - 5-hydroxy-α-gurjunene
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ChEBI Name
5-hydroxy-α-gurjunene
ChEBI ID
CHEBI:138167
ChEBI ASCII Name
5-hydroxy-alpha-gurjunene
Definition
A tricyclic sesquiterpenoid obtained by formal hydration across the endocyclic double bond of (−)-α-gurjunene
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
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Formula
C15H26O
Net Charge
0
Average Mass
222.367
Monoisotopic Mass
222.19837
InChI
InChI=1S/C15H26O/c1-
9-
5-
7-
12-
13(14(12,3)
4)
15(16)
10(2)
6-
8-
11(9)
15/h9-
13,16H,5-
8H2,1-
4H3/t9-
,10?,11-
,12-
,13+,15?/m1/s1
InChIKey
OHFMYRJCMYNZKO-KUKPGQNJSA-N
SMILES
[C@]12(CC[C@H]([C@@]3(C([C@@]1(C2(C)C)[H])(C(CC3)C)O)[H])C)[H]
ChEBI Ontology
Outgoing
5-hydroxy-α-gurjunene (
CHEBI:138167
)
has functional parent
(−)-α-gurjunene (
CHEBI:61699
)
5-hydroxy-α-gurjunene (
CHEBI:138167
)
is a
carbotricyclic compound (
CHEBI:38032
)
5-hydroxy-α-gurjunene (
CHEBI:138167
)
is a
sesquiterpenoid (
CHEBI:26658
)
5-hydroxy-α-gurjunene (
CHEBI:138167
)
is a
tertiary alcohol (
CHEBI:26878
)
IUPAC Name
(1a
R
,4
R
,4a
R
,7b
S
)-
1,1,4,7-
tetramethyldecahydro-
7a
H
-
cyclopropa[
e
]azulen-
7a-
ol
Synonym
Source
5-hydroxy-α-gurjunene
UniProt
Manual Xref
Database
CPD-20252
MetaCyc
View more database links
Citation
Type
Source
27650333
PubMed citation
SUBMITTER
Last Modified
24 October 2017