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(-)jasmonic acid L-phenylalanine

PropertiesImage
MNX_IDMNXM13450 Image of MNXM13450
referencechebi:137130
formulaC21H27NO4
global charge0
mol weight357.45
InChIKeyBYYWRCJZFSTRMQ-WSKZCNLGSA-N
InChIInChI=1S/C21H27NO4/c1-2-3-5-10-17-16(11-12-19(17)23)14-20(24)22-18(21(25)26)13-15-8-6-4-7-9-15/h3-9,16-18H,2,10-14H2,1H3,(H,22,24)(H,25,26)/b5-3-/t16-,17-,18+/m1/s1
SMILESCC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O
MNX internals
InChI (mnx)InChI=1/C21H27NO4/c1-2-3-5-10-17-16(11-12-19(17)23)14-20(24)22-18(21(25)26)13-15-8-6-4-7-9-15/h3-9,16-18H,2,10-14H2,1H3,(H,22,24)(H,25,26)/b5-3-/t16-,17-,18+/m1/s1 Image of MNXM13450
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:5]\[CH2:10][C@@H:17]1[C@@H:16]([CH2:14][C:20](=[N:22][C@@H:18]([CH2:13][C:15]2=[CH:8][CH:6]=[CH:4][CH:7]=[CH:9]2)[C:21](=[O:25])[OH:26])[OH:24])[CH2:11][CH2:12][C:19]1=[O:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:137130
chebi:137130
BYYWRCJZFSTRMQ-WSKZCNLGSA-N 		(-)jasmonic acid L-phenylalanine

seed.compound:cpd22907
seedM:cpd22907
BYYWRCJZFSTRMQ-WSKZCNLGSA-M 		(-) jasmonic acid L-phenylalanine
(-) jasmonic acid L-phenylalanine conjugate
(-)-JA-L-Phe
(-)-jasmonate-L-phenylalanine
(-)-jasmonoyl-L-phenylalanine
(-)-jasmonyl-L-phenylalanine
(-)-phenylalanine L-jasmonate conjugate
N-[(3R,7R)-(-)-jasmonoyl]-(S)-phenylalanine

metacyc.compound:CPD-11235
metacycM:CPD-11235
BYYWRCJZFSTRMQ-WSKZCNLGSA-M 		(-)-jasmonoyl-L-phenylalanine
(-) jasmonic acid L-phenylalanine
(-) jasmonic acid L-phenylalanine conjugate
(-)-JA-L-Phe
(-)-jasmonate-L-phenylalanine
(-)-jasmonyl-L-phenylalanine
(-)-phenylalanine L-jasmonate conjugate
N-[(3R,7R)-(-)-jasmonoyl]-(S)-phenylalanine

seedM:M_cpd22907 		secondary/obsolete/fantasy identifier