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> Main
CHEBI:70530 - meliastatin 5
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ChEBI Ontology
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ChEBI Name
meliastatin 5
ChEBI ID
CHEBI:70530
Definition
A natural product found in
Melia toosendan
.
Stars
This entity has been manually annotated by a third party.
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Formula
C30H48O3
Net Charge
0
Average Mass
456.70030
Monoisotopic Mass
456.36035
InChI
InChI=1S/C30H48O3/c1-
18(2)
22(31)
11-
9-
19(3)
26-
23(32)
17-
30(8)
21-
10-
12-
24-
27(4,5)
25(33)
14-
15-
28(24,6)
20(21)
13-
16-
29(26,30)
7/h10,19-
20,22-
24,26,31-
32H,1,9,11-
17H2,2-
8H3/t19-
,20+,22+,23+,24+,26-
,28-
,29+,30-
/m1/s1
InChIKey
ZTTLEOUJUZYDTO-HEBSBEFESA-N
SMILES
[H]
[C@]
12CC[C@@]
3(C)
[C@]
([H]
)
([C@H]
(C)
CC[C@H]
(O)
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
meliastatin 5 (
CHEBI:70530
)
has role
metabolite (
CHEBI:25212
)
meliastatin 5 (
CHEBI:70530
)
is a
triterpenoid (
CHEBI:36615
)
Synonym
Source
(13alpha,14beta,16beta,17alpha,24S)-16,24-Dihydroxylanosta-7,25-dien-3-one
ChEBI
Citation
Type
Source
20961091
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:cholanoid(CHEBI:36078); 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);