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N-(indole-3-acetyl)-L-alanine

MNXM11871 is deprecated and here replaced by MNXM726473
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM726473 Image of MNXM726473
referencechebi:71672
formulaC13H14N2O3
global charge0
mol weight246.266
InChIKeyFBDCJLXTUCMFLF-QMMMGPOBSA-N
InChIInChI=1S/C13H14N2O3/c1-8(13(17)18)15-12(16)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7-8,14H,6H2,1H3,(H,15,16)(H,17,18)/t8-/m0/s1
SMILESC[C@H](NC(=O)CC1=CNC2=CC=CC=C12)C(=O)O
MNX internals
InChI (mnx)InChI=1/C13H14N2O3/c1-8(13(17)18)15-12(16)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7-8,14H,6H2,1H3,(H,15,16)(H,17,18)/t8-/m0/s1 Image of MNXM726473
SMILES (mnx)[CH3:1][C@@H:8]([C:13](=[O:17])[OH:18])[N:15]=[C:12]([CH2:6][C:9]1=[CH:7][NH:14][C:11]2=[CH:5][CH:3]=[CH:2][CH:4]=[C:10]12)[OH:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:71672
chebi:71672
FBDCJLXTUCMFLF-QMMMGPOBSA-N 		N-(indole-3-acetyl)-L-alanine
IAA-Ala
IAA-L-Ala
N-(1H-indol-3-ylacetyl)-L-alanine
N-(indole-3-acetyl)alanine

metacyc.compound:INDOLE-3-ACETYL-ALA
metacycM:INDOLE-3-ACETYL-ALA
FBDCJLXTUCMFLF-QMMMGPOBSA-M 		(indol-3-yl)acetyl-L-alanine
IAA-Ala
indole-3-acetyl-ala

seed.compound:cpd27274
seedM:cpd27274
FBDCJLXTUCMFLF-QMMMGPOBSA-M 		IAA-Ala
indole-3-acetyl-L-alanine
indole-3-acetyl-ala
indole-3-acetyl-alanine

seedM:M_cpd27274 		secondary/obsolete/fantasy identifier