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CHEBI:69315 - endiandramide A
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ChEBI Name
endiandramide A
ChEBI ID
CHEBI:69315
Definition
A natural product found in
Beilschmiedia tsangii
.
Stars
This entity has been manually annotated by a third party.
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Formula
C26H31NO3
Net Charge
0
Average Mass
405.52920
Monoisotopic Mass
405.23039
InChI
InChI=1S/C26H31NO3/c1-
14(2)
12-
27-
26(28)
19-
5-
4-
16-
11-
21-
20(18-
7-
6-
17(19)
24(16)
25(18)
21)
9-
15-
3-
8-
22-
23(10-
15)
30-
13-
29-
22/h3-
8,10,14,16-
21,24-
25H,9,11-
13H2,1-
2H3,(H,27,28)
/t16-
,17+,18-
,19-
,20-
,21+,24-
,25-
/m1/s1
InChIKey
VJYDYOYYSFAXSI-DLGBIPEUSA-N
SMILES
[H]
[C@]
12C[C@@]
3([H]
)
[C@H]
(Cc4ccc5OCOc5c4)
[C@@]
4([H]
)
C=C[C@@]
([H]
)
([C@@H]
(C=C1)
C(=O)
NCC(C)
C)
[C@]
2([H]
)
[C@@]
34[H]
Metabolite of Species
Details
Beilschmiedia tsangii
(IPNI:462970-1)
Found in root
(BTO:0001188)
. Cold MeOH extract of dry and sliced roots 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
endiandramide A (
CHEBI:69315
)
has role
metabolite (
CHEBI:25212
)
endiandramide A (
CHEBI:69315
)
is a
benzodioxoles (
CHEBI:38298
)
Synonym
Source
(1S,1aS,2aS,5R,5aR,7aR,7bS,7cS)-
1-
(1,3-
Benzodioxol-
5-
ylmethyl)-
N-
isobutyl-
1a,2,2a,5,5a,7a,7b,7c-
octahydro-
1H-
cyclobuta[bc]acenaphthylene-
5-
carboxamide
ChEBI
Citation
Type
Source
21846089
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:aralkylamine(CHEBI:18000); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:carboxamide(CHEBI:37622); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:acetal(CHEBI:59769); ISA:carbonyl compound(CHEBI:36586);