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CHEBI:70269 - cabraleahydroxylactone
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ChEBI Name
cabraleahydroxylactone
ChEBI ID
CHEBI:70269
Definition
A tetracyclic triterpenoid isolated from the stems of
Aglaia abbreviata
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C27H44O3
Net Charge
0
Average Mass
416.63650
Monoisotopic Mass
416.32905
InChI
InChI=1S/C27H44O3/c1-
23(2)
19-
10-
15-
26(5)
20(24(19,3)
13-
11-
21(23)
28)
8-
7-
17-
18(9-
14-
25(17,26)
4)
27(6)
16-
12-
22(29)
30-
27/h17-
21,28H,7-
16H2,1-
6H3/t17-
,18+,19+,20-
,21-
,24+,25-
,26-
,27+/m1/s1
InChIKey
AHDUWGQSZYSNEY-HUOCPXEISA-N
SMILES
C[C@]1(CCC(=O)O1)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@@H](O)C(C)(C)[C@@H]3CC[C@@]21C
Metabolite of Species
Details
Aglaia abbreviata
(IPNI:576946-1)
Found in stem
(BTO:0001300)
. 95% ethanolic extract of air-dried stems See:
PubMed
Roles Classification
Biological Role
(s):
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
cabraleahydroxylactone (
CHEBI:70269
)
has role
plant metabolite (
CHEBI:76924
)
cabraleahydroxylactone (
CHEBI:70269
)
is a
γ-lactone (
CHEBI:37581
)
cabraleahydroxylactone (
CHEBI:70269
)
is a
secondary alcohol (
CHEBI:35681
)
cabraleahydroxylactone (
CHEBI:70269
)
is a
tetracyclic triterpenoid (
CHEBI:26893
)
IUPAC Name
(3α,5α)-3-hydroxy-4,4,8,14-tetramethyl-20,24-epoxy-18-norcholan-24-one
Registry Number
Type
Source
1628323
Reaxys Registry Number
Reaxys
Citation
Type
Source
21087017
PubMed citation
Europe PMC
Last Modified
01 June 2015