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> Main
CHEBI:68105 - beta-sitostenone
Main
ChEBI Ontology
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ChEBI Name
beta-sitostenone
ChEBI ID
CHEBI:68105
Definition
A natural product found in
Radermachera boniana
.
Stars
This entity has been manually annotated by a third party.
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Formula
C29H48O
Net Charge
0
Average Mass
412.69080
Monoisotopic Mass
412.37052
InChI
InChI=1S/C29H48O/c1-
7-
21(19(2)
3)
9-
8-
20(4)
25-
12-
13-
26-
24-
11-
10-
22-
18-
23(30)
14-
16-
28(22,5)
27(24)
15-
17-
29(25,26)
6/h18-
21,24-
27H,7-
17H2,1-
6H3/t20-
,21-
,24+,25-
,26+,27+,28+,29-
/m1/s1
InChIKey
RUVUHIUYGJBLGI-XJZKHKOHSA-N
SMILES
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CC[C@@H](CC)C(C)C
Metabolite of Species
Details
Radermachera boniana
(IPNI:110489-1)
Found in twig
(BTO:0001411)
. Ethylacetate extract of dried and ground mixture of twigs and leaves See:
PubMed
Radermachera boniana
(IPNI:110489-1)
Found in leaf
(BTO:0000713)
. Ethylacetate extract of dried and ground mixture of twigs and leaves See:
PubMed
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
beta-sitostenone (
CHEBI:68105
)
has parent hydride
stigmastane (
CHEBI:26773
)
beta-sitostenone (
CHEBI:68105
)
has role
metabolite (
CHEBI:25212
)
beta-sitostenone (
CHEBI:68105
)
is a
C
29
-steroid (
CHEBI:188923
)
beta-sitostenone (
CHEBI:68105
)
is a
steroid (
CHEBI:35341
)
Synonym
Source
Stigmast-4-en-3-one
ChEBI
Manual Xref
Database
0001058613
ChemIDplus
View more database links
Citation
Type
Source
21469696
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:triterpenoid(CHEBI:36615); ISA:3-oxo Delta(4)-steroid(CHEBI:47909); ISA:steroid(CHEBI:35341); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:cyclic ketone(CHEBI:3992);