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CHEBI:70343 - Hirsutalin D, (rel)-
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ChEBI Ontology
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ChEBI Name
Hirsutalin D, (rel)-
ChEBI ID
CHEBI:70343
Definition
A natural product found in
Cladiella hirsuta
.
Stars
This entity has been manually annotated by a third party.
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Formula
C26H40O7
Net Charge
0
Average Mass
464.59160
Monoisotopic Mass
464.27740
InChI
InChI=1S/C26H40O7/c1-
7-
20(31-
17(5)
28)
25(30)
33-
26(6)
11-
10-
19(29)
15(3)
12-
21-
22-
14(2)
8-
9-
18(16(4)
13-
27)
23(22)
24(26)
32-
21/h16,18-
24,27,29H,2-
3,7-
13H2,1,4-
6H3/t16-
,18+,19-
,20?,21+,22+,23+,24+,26+/m0/s1
InChIKey
QEAWUOKMRPXMSH-HMHWPQCPSA-N
SMILES
[H]
[C@]
12CC(=C)
[C@@H]
(O)
CC[C@@]
(C)
(OC(=O)
C(CC)
OC(C)
=O)
[C@]
([H]
)
(O1)
[C@]
1([H]
)
[C@]
([H]
)
(CCC(=C)
[C@]
21[H]
)
[C@@H]
(C)
CO
Metabolite of Species
Details
Cladiella hirsuta
(WORMS:288617)
Sliced frozen bodies extracted with acetone 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
Hirsutalin D, (rel)- (
CHEBI:70343
)
has role
metabolite (
CHEBI:25212
)
Hirsutalin D, (rel)- (
CHEBI:70343
)
is a
sesquiterpenoid (
CHEBI:26658
)
Citation
Type
Source
20979397
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:monosaccharide(CHEBI:35381); ISA:oxolanes(CHEBI:26912); ISA:carboxylic ester(CHEBI:33308); ISA:secondary alcohol(CHEBI:35681); ISA:monocarboxylic acid(CHEBI:25384); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:primary alcohol(CHEBI:15734); ISA:carbonyl compound(CHEBI:36586);