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(Q77509307)
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English
Notoamide J
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
3-[[6-hydroxy-3-(2-methylbut-3-en-2-yl)-2-oxo-1H-indol-3-yl]methyl]-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
1 reference
based on heuristic
inferred from SMILES
mass
383.18450628
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₅N₃O₄
0 references
canonical SMILES
C=CC(C)(C)C1(CC2NC(=O)C3CCCN3C2=O)C(=O)Nc2cc(O)ccc21
0 references
isomeric SMILES
CC(C)(C=C)[C@]1(C2=C(C=C(C=C2)O)NC1=O)C[C@H]3C(=O)N4CCC[C@H]4C(=O)N3
0 references
found in taxon
Aspergillus
2 references
stated in
Notoamides A—D: Prenylated Indole Alkaloids Isolated from a Marine-Derived Fungus, Aspergillus sp.
stated in
Notoamides F-K, prenylated indole alkaloids isolated from a marine-derived Aspergillus sp.
Identifiers
InChI
InChI=1S/C21H25N3O4/c1-4-20(2,3)21(13-8-7-12(25)10-14(13)23-19(21)28)11-15-18(27)24-9-5-6-16(24)17(26)22-15/h4,7-8,10,15-16,25H,1,5-6,9,11H2,2-3H3,(H,22,26)(H,23,28)/t15-,16-,21-/m0/s1
0 references
InChIKey
YTISGDQKEGUAFL-QYWGDWMGSA-N
2 references
stated in
PubChem
PubChem CID
25180709
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
25180709
language of work or name
English
PubChem CID
25180709
2 references
stated in
PubChem
PubChem CID
25180709
language of work or name
English
matched by identifier from
InChIKey
InChIKey
YTISGDQKEGUAFL-QYWGDWMGSA-N
ChEBI ID
224669
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C21H25N3O4/c1-4-20(2,3)21(13-8-7-12(25)10-14(13)23-19(21)28)11-15-18(27)24-9-5-6-16(24)17(26)22-15/h4,7-8,10,15-16,25H,1,5-6,9,11H2,2-3H3,(H,22,26)(H,23,28)/t15-,16-,21-/m0/s1
UniChem compound ID
51043
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA012497
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YTISGDQKEGUAFL-QYWGDWMGSA-N
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