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> Main
CHEBI:68383 - stigmasterol 3-
O
-β-
D
-glucoside
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ChEBI Ontology
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ChEBI Name
stigmasterol 3-
O
-β-
D
-glucoside
ChEBI ID
CHEBI:68383
ChEBI ASCII Name
stigmasterol 3-O-beta-D-glucoside
Definition
A steroid saponin that is (3β,22
E
)-stigmasta-5,22-dien-3-ol attached to a β-
D
-glucopyranosyl residue at position 3 via a glycosidic linkage. It is isolated from
Symplocos lancifolia
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C35H58O6
Net Charge
0
Average Mass
574.83140
Monoisotopic Mass
574.42334
InChI
InChI=1S/C35H58O6/c1-
7-
22(20(2)
3)
9-
8-
21(4)
26-
12-
13-
27-
25-
11-
10-
23-
18-
24(14-
16-
34(23,5)
28(25)
15-
17-
35(26,27)
6)
40-
33-
32(39)
31(38)
30(37)
29(19-
36)
41-
33/h8-
10,20-
22,24-
33,36-
39H,7,11-
19H2,1-
6H3/b9-
8+/t21-
,22-
,24+,25+,26-
,27+,28+,29-
,30-
,31+,32-
,33-
,34+,35-
/m1/s1
InChIKey
VWDLOXMZIGUBKM-AUGXRQBFSA-N
SMILES
[H]
[C@@]
1(O[C@H]
2CC[C@@]
3(C)
C(C2)
=CC[C@]
2([H]
)
[C@]
3([H]
)
CC[C@]
3(C)
[C@]
([H]
)
(CC[C@@]
23[H]
)
[C@H]
(C)
\C=C\[C@@H]
(CC)
C(C)
C)
O[C@H]
(CO)
[C@@H]
(O)
[C@H]
(O)
[C@H]
1O
Metabolite of Species
Details
Symplocos lancifolia
(NCBI:txid239704)
Found in leaf
(BTO:0000713)
. Dried, powdered leaves extracted with boiling 80% methanol 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.
(via
saponin
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
stigmasterol 3-
O
-β-
D
-glucoside (
CHEBI:68383
)
has functional parent
stigmasterol (
CHEBI:28824
)
stigmasterol 3-
O
-β-
D
-glucoside (
CHEBI:68383
)
has parent hydride
stigmastane (
CHEBI:26773
)
stigmasterol 3-
O
-β-
D
-glucoside (
CHEBI:68383
)
has role
metabolite (
CHEBI:25212
)
stigmasterol 3-
O
-β-
D
-glucoside (
CHEBI:68383
)
is a
β-
D
-glucoside (
CHEBI:22798
)
stigmasterol 3-
O
-β-
D
-glucoside (
CHEBI:68383
)
is a
monosaccharide derivative (
CHEBI:63367
)
stigmasterol 3-
O
-β-
D
-glucoside (
CHEBI:68383
)
is a
phytosterols (
CHEBI:26125
)
stigmasterol 3-
O
-β-
D
-glucoside (
CHEBI:68383
)
is a
steroid saponin (
CHEBI:61655
)
IUPAC Name
(3β,22
E
)-stigmasta-5,22-dien-3-yl β-
D
-glucopyranoside
Synonym
Source
stigmasteryl 3-β-
D
-glucoside
UniProt
Registry Number
Type
Source
4302422
Reaxys Registry Number
Reaxys
Citation
Type
Source
21288041
PubMed citation
Europe PMC
Last Modified
15 November 2019