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CHEBI:140467 - gypsogenin(1−)
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ChEBI Name
gypsogenin(1−)
ChEBI ID
CHEBI:140467
ChEBI ASCII Name
gypsogenin(1-)
Definition
A monocarboxylic acid anion that is the conjugate base of gypsogenin, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
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Formula
C30H45O4
Net Charge
-1
Average Mass
469.677
Monoisotopic Mass
469.33233
InChI
InChI=1S/C30H46O4/c1-
25(2)
13-
15-
30(24(33)
34)
16-
14-
28(5)
19(20(30)
17-
25)
7-
8-
22-
26(3)
11-
10-
23(32)
27(4,18-
31)
21(26)
9-
12-
29(22,28)
6/h7,18,20-
23,32H,8-
17H2,1-
6H3,(H,33,34)
/p-
1/t20-
,21+,22+,23-
,26-
,27-
,28+,29+,30-
/m0/s1
InChIKey
QMHCWDVPABYZMC-MYPRUECHSA-M
SMILES
C1C[C@]
2([C@]
([C@]
([C@H]
1O)
(C)
C=O)
(CC[C@@]
3([C@@]
2(CC=C4[C@]
3(CC[C@@]
5([C@]
4(CC(CC5)
(C)
C)
[H]
)
C([O-
]
)
=O)
C)
[H]
)
C)
[H]
)
C
ChEBI Ontology
Outgoing
gypsogenin(1−) (
CHEBI:140467
)
is a
monocarboxylic acid anion (
CHEBI:35757
)
gypsogenin(1−) (
CHEBI:140467
)
is conjugate base of
gypsogenin (
CHEBI:5580
)
Incoming
gypsogenin (
CHEBI:5580
)
is conjugate acid of
gypsogenin(1−) (
CHEBI:140467
)
IUPAC Name
3β-hydroxy-23-oxoolean-12-en-28-oate
Synonyms
Sources
(3β)-3-hydroxy-23-oxoolean-12-en-28-oate
IUPAC
gypsogenin
UniProt
Manual Xref
Database
CPD-9470
MetaCyc
View more database links
Last Modified
12 April 2018