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(Q77569957)
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English
3-(2'-acetoxy-3'-oxo-4’-methylhexyl)-indole
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
[(2R)-1-(1H-indol-3-yl)-4-methyl-3-oxohexan-2-yl] acetate
1 reference
based on heuristic
inferred from SMILES
mass
287.152143532
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₁NO₃
0 references
canonical SMILES
O=C(OC(C(=O)C(C)CC)CC1=CNC=2C=CC=CC21)C
0 references
found in taxon
Xenorhabdus bovienii
1 reference
stated in
Antimicrobial metabolites from a bacterial symbiont
Identifiers
InChI
InChI=1S/C17H21NO3/c1-4-11(2)17(20)16(21-12(3)19)9-13-10-18-15-8-6-5-7-14(13)15/h5-8,10-11,16,18H,4,9H2,1-3H3
0 references
InChIKey
QIUGSZAEYGGUPJ-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
15285576
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
15285576
language of work or name
English
PubChem CID
15285576
2 references
stated in
PubChem
PubChem CID
15285576
language of work or name
English
matched by identifier from
InChIKey
InChIKey
QIUGSZAEYGGUPJ-UHFFFAOYSA-N
ChEBI ID
221219
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H21NO3/c1-4-11(2)17(20)16(21-12(3)19)9-13-10-18-15-8-6-5-7-14(13)15/h5-8,10-11,16,18H,4,9H2,1-3H3
UniChem compound ID
204126
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA016203
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QIUGSZAEYGGUPJ-UHFFFAOYSA-N
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