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> Main
CHEBI:69433 - β-sitosterol 3-
O
-acetate
Main
ChEBI Ontology
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ChEBI Name
β-sitosterol 3-
O
-acetate
ChEBI ID
CHEBI:69433
ChEBI ASCII Name
beta-sitosterol 3-O-acetate
Definition
A steroid ester obtained by the formal condensation of the hydroxy group of β-sitosterol with acetic acid. It has been isolated from the mycelia of
Cordyceps sinensis
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C31H52O2
Net Charge
0
Average Mass
456.74340
Monoisotopic Mass
456.39673
InChI
InChI=1S/C31H52O2/c1-
8-
23(20(2)
3)
10-
9-
21(4)
27-
13-
14-
28-
26-
12-
11-
24-
19-
25(33-
22(5)
32)
15-
17-
30(24,6)
29(26)
16-
18-
31(27,28)
7/h11,20-
21,23,25-
29H,8-
10,12-
19H2,1-
7H3/t21-
,23-
,25+,26+,27-
,28+,29+,30+,31-
/m1/s1
InChIKey
PBWOIPCULUXTNY-LBKBYZTLSA-N
SMILES
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O)C(C)C
Metabolite of Species
Details
Cordyceps sinensis
(NCBI:txid72228)
Found in mycelium
(BTO:0001436)
. EtOH extract of dried mycelia, mixture of beta-sitosterol 3-O-acetate and stigmasterol 3-O-acetate See:
PubMed
Roles Classification
Biological Role
(s):
fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
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
β-sitosterol 3-
O
-acetate (
CHEBI:69433
)
has functional parent
sitosterol (
CHEBI:27693
)
β-sitosterol 3-
O
-acetate (
CHEBI:69433
)
has parent hydride
stigmastane (
CHEBI:26773
)
β-sitosterol 3-
O
-acetate (
CHEBI:69433
)
has role
fungal metabolite (
CHEBI:76946
)
β-sitosterol 3-
O
-acetate (
CHEBI:69433
)
has role
plant metabolite (
CHEBI:76924
)
β-sitosterol 3-
O
-acetate (
CHEBI:69433
)
is a
acetate ester (
CHEBI:47622
)
β-sitosterol 3-
O
-acetate (
CHEBI:69433
)
is a
steroid ester (
CHEBI:47880
)
IUPAC Name
stigmast-5-en-3β-yl acetate
Synonyms
Sources
3β-acetoxystigmast-5-ene
ChEBI
β-sitosterol acetate
HMDB
β-sitosteryl acetate
HMDB
Manual Xref
Database
HMDB0030151
HMDB
View more database links
Registry Numbers
Types
Sources
1916957
Reaxys Registry Number
Reaxys
915-05-9
CAS Registry Number
ChemIDplus
Citations
Types
Sources
11429262
PubMed citation
Europe PMC
12774386
PubMed citation
Europe PMC
16276968
PubMed citation
Europe PMC
18831204
PubMed citation
Europe PMC
21848266
PubMed citation
Europe PMC
23016273
PubMed citation
Europe PMC
Last Modified
14 January 2014