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(Q77508846)
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English
1H-Indole-3-carboxylic acid, 1-(1,1-dimethyl-2-propenyl)-, methyl ester
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
indole alkaloid
0 references
mass
243.125928784
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₇NO₂
0 references
canonical SMILES
CC(C)(C=C)N1C=C(C2=CC=CC=C21)C(=O)OC
0 references
found in taxon
Elmerina caryae
1 reference
stated in
Indole alkaloids from a culture of the fungus Aporpium caryae
Identifiers
InChI
InChI=1S/C15H17NO2/c1-5-15(2,3)16-10-12(14(17)18-4)11-8-6-7-9-13(11)16/h5-10H,1H2,2-4H3
0 references
InChIKey
YVHMEMILZVDHEE-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
11776547
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
11776547
language of work or name
English
CAS Registry Number
306776-02-3
0 references
PubChem CID
11776547
2 references
stated in
PubChem
PubChem CID
11776547
language of work or name
English
matched by identifier from
InChIKey
InChIKey
YVHMEMILZVDHEE-UHFFFAOYSA-N
ChEBI ID
224334
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H17NO2/c1-5-15(2,3)16-10-12(14(17)18-4)11-8-6-7-9-13(11)16/h5-10H,1H2,2-4H3
UniChem compound ID
32169031
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80472387
1 reference
matched by identifier from
InChIKey
InChIKey
YVHMEMILZVDHEE-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10423201
0 references
Natural Product Atlas ID
NPA012425
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YVHMEMILZVDHEE-UHFFFAOYSA-N
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