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> Main
CHEBI:70528 - kulinone
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ChEBI Ontology
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ChEBI Name
kulinone
ChEBI ID
CHEBI:70528
Definition
A natural product found in
Melia toosendan
.
Stars
This entity has been manually annotated by a third party.
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Formula
C30H48O2
Net Charge
0
Average Mass
440.70090
Monoisotopic Mass
440.36543
InChI
InChI=1S/C30H48O2/c1-
19(2)
10-
9-
11-
20(3)
26-
23(31)
18-
30(8)
22-
12-
13-
24-
27(4,5)
25(32)
15-
16-
28(24,6)
21(22)
14-
17-
29(26,30)
7/h10,12,20-
21,23-
24,26,31H,9,11,13-
18H2,1-
8H3/t20-
,21+,23+,24+,26-
,28-
,29+,30-
/m1/s1
InChIKey
YORJEFOAAXJWIS-QOXWJFHWSA-N
SMILES
[H]
[C@]
12CC[C@@]
3(C)
[C@]
([H]
)
([C@H]
(C)
CCC=C(C)
C)
[C@@H]
(O)
C[C@]
3(C)
C1=CC[C@@]
1([H]
)
C(C)
(C)
C(=O)
CC[C@]
21C
Metabolite of Species
Details
Melia toosendan
(NCBI:txid71608)
Found in fruit
(BTO:0000486)
. 95% ethanolic extract of dried fruits 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
kulinone (
CHEBI:70528
)
has role
metabolite (
CHEBI:25212
)
kulinone (
CHEBI:70528
)
is a
triterpenoid (
CHEBI:36615
)
Synonym
Source
Lanosta-7,24-dien-3-one,16-hydroxy-,(13alpha,14beta,16beta,17alpha)-
ChEBI
Registry Number
Type
Source
21688-61-9
CAS Registry Number
ChemIDplus
Citation
Type
Source
20961091
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:cholestanoid(CHEBI:50401); ISA:16beta-hydroxy steroid(CHEBI:17354); ISA:3-oxo Delta(7)-steroid(CHEBI:71598); ISA:3-oxo steroid(CHEBI:47788); ISA:steroid(CHEBI:35341); ISA:cyclohexanones(CHEBI:23482); ISA:organic hydroxy compound(CHEBI:33822); ISA:secondary alcohol(CHEBI:35681);