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> Main
CHEBI:67722 - Isofurospongin-4
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ChEBI Name
Isofurospongin-4
ChEBI ID
CHEBI:67722
Definition
A natural product found in
Spongia officinalis
.
Stars
This entity has been manually annotated by a third party.
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Formula
C26H36O5
Net Charge
0
Average Mass
428.56100
Monoisotopic Mass
428.25627
InChI
InChI=1S/C26H36O5/c1-
20(11-
6-
14-
23-
17-
18-
31-
19-
23)
9-
5-
10-
21(2)
12-
7-
15-
24(26(29)
30-
4)
16-
8-
13-
22(3)
25(27)
28/h10-
11,13,15,17-
19H,5-
9,12,14,16H2,1-
4H3,(H,27,28)
/b20-
11+,21-
10+,22-
13+,24-
15-
InChIKey
OAOUOCLVLBNQNV-STZPRAENSA-N
SMILES
COC(=O)C(\CC\C=C(/C)C(O)=O)=C/CC\C(C)=C\CC\C(C)=C\CCc1ccoc1
Metabolite of Species
Details
Spongia officinalis
(NCBI:txid252964)
Diethyl ether soluble portion of acetone extract of chopped, frozen sponge 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
Isofurospongin-4 (
CHEBI:67722
)
has role
metabolite (
CHEBI:25212
)
Isofurospongin-4 (
CHEBI:67722
)
is a
diterpenoid (
CHEBI:23849
)
Synonym
Source
(2E,6Z,10E,14E)-
17-
(furan-
3-
yl)-
6-
methoxycarbonyl-
2,10,14-
trimethylheptadeca-
2,6,10,14-
tetraenoic acid
ChEBI
Citation
Type
Source
21548580
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:fatty acid ester(CHEBI:35748); ISA:dicarboxylic acid(CHEBI:35692); ISA:furans(CHEBI:24129); ISA:carboxylic ester(CHEBI:33308); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enoate ester(CHEBI:51702); ISA:ether(CHEBI:25698); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);