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CHEBI:229693 - cephalot-3(4)-ene
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ChEBI Ontology
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ChEBI Name
cephalot-3(4)-ene
ChEBI ID
CHEBI:229693
Definition
A diterpene that is produced by a diterpene synthase from
Cephalotaxus sinensis
.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Martin Engst
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Formula
C20H32
Net Charge
0
Average Mass
272.476
Monoisotopic Mass
272.25040
InChI
InChI=1S/C20H32/c1-
13-
6-
5-
9-
19(3)
10-
11-
20(4)
14(2)
7-
8-
15-
12-
16(13)
18(19)
17(15)
20/h6,14-
18H,5,7-
12H2,1-
4H3/t14-
,15+,16-
,17+,18-
,19+,20+/m1/s1
InChIKey
VPEXEKPLIFYXOK-PHUPPTAPSA-N
SMILES
[H][C@@]12C[C@]3([H])C(C)=CCC[C@@]4(C)CC[C@@](C)([C@H](C)CC1)[C@]2([H])[C@@]34[H]
Metabolite of Species
Details
Cephalotaxus sinensis
( NCBI:txid89484)
See:
PubMed
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cephalot-3(4)-ene (
CHEBI:229693
)
has role
plant metabolite (
CHEBI:76924
)
cephalot-3(4)-ene (
CHEBI:229693
)
is a
carbotetracyclic compound (
CHEBI:177332
)
cephalot-3(4)-ene (
CHEBI:229693
)
is a
diterpene (
CHEBI:35190
)
cephalot-3(4)-ene (
CHEBI:229693
)
is a
polycyclic olefin (
CHEBI:35714
)
IUPAC Name
(1
R
,3a
S
,4a
S
,8a
S
,10a
S
,10b
S
,10c
R
)-
1,5,8a,10a-
tetramethyl-
1,2,3,3a,4,4a,7,8,8a,9,10,10a,10b,10c-
tetradecahydrocyclohepta[
bc
]acenaphthylene
Synonym
Source
cephalotene
SUBMITTER
Citation
Type
Source
37326357
PubMed citation
SUBMITTER
Last Modified
28 February 2024