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> Main
CHEBI:67711 - 3-epi-gitingensine
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ChEBI Ontology
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ChEBI Name
3-epi-gitingensine
ChEBI ID
CHEBI:67711
Definition
A natural product found in
Kibatalia laurifolia
.
Stars
This entity has been manually annotated by a third party.
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Formula
C21H31NO2
Net Charge
0
Average Mass
329.47630
Monoisotopic Mass
329.23548
InChI
InChI=1S/C21H31NO2/c1-
12-
16-
5-
6-
18-
15-
4-
3-
13-
11-
14(22)
7-
9-
20(13,2)
17(15)
8-
10-
21(16,18)
19(23)
24-
12/h3,12,14-
18H,4-
11,22H2,1-
2H3/t12-
,14-
,15+,16+,17-
,18-
,20-
,21-
/m0/s1
InChIKey
LFGPYDIPRZAYQB-DFJIJILOSA-N
SMILES
[H][C@]12CC[C@@]3([H])[C@]4([H])CC=C5C[C@@H](N)CC[C@]5(C)[C@@]4([H])CC[C@]13C(=O)O[C@H]2C
Metabolite of Species
Details
Kibatalia laurifolia
(IPNI:79456-1)
Found in leaf
(BTO:0000713)
. Dried, ground leaves were alkalized with NH4OH & extracted successively with n-hexane, CH2Cl2 & MeOH 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
3-epi-gitingensine (
CHEBI:67711
)
has role
metabolite (
CHEBI:25212
)
3-epi-gitingensine (
CHEBI:67711
)
is a
steroid (
CHEBI:35341
)
Synonym
Source
3beta-amino-20-hydroxy-5-pregnen-18-oic acid-gamma-lactone
ChEBI
Citation
Type
Source
21443172
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:terpene lactone(CHEBI:37668); ISA:sesquiterpenoid(CHEBI:26658); ISA:primary aliphatic amine(CHEBI:17062); ISA:gamma-lactone(CHEBI:37581); ISA:oxolanes(CHEBI:26912); ISA:carboxylic ester(CHEBI:33308); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:alkylamine(CHEBI:13759); ISA:carbonyl compound(CHEBI:36586);