Search MNXref
 Feedback

L-isoleucine-(+)-12-hydroxy-7-isojasmonate

PropertiesImage
MNX_IDMNXM13561 Image of MNXM13561
referencechebi:136181
formulaC18H28NO5
global charge-1
mol weight338.424
InChIKeyTXHIPUZLOILIIU-RAJZRIHCSA-M
InChIInChI=1S/C18H29NO5/c1-3-12(2)17(18(23)24)19-16(22)11-13-8-9-15(21)14(13)7-5-4-6-10-20/h4-5,12-14,17,20H,3,6-11H2,1-2H3,(H,19,22)(H,23,24)/p-1/b5-4-/t12-,13+,14-,17-/m0/s1
SMILESCC[C@H](C)[C@H](NC(=O)C[C@H]1CCC(=O)[C@H]1C/C=C\CCO)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C18H29NO5/c1-3-12(2)17(18(23)24)19-16(22)11-13-8-9-15(21)14(13)7-5-4-6-10-20/h4-5,12-14,17,20H,3,6-11H2,1-2H3,(H,19,22)(H,23,24)/b5-4-/t12-,13+,14-,17-/m0/s1 Image of MNXM13561
SMILES (mnx)[CH3:1][CH2:3][C@H:12]([CH3:2])[C@@H:17]([C:18](=[O:23])[OH:24])[N:19]=[C:16]([CH2:11][C@H:13]1[CH2:8][CH2:9][C:15](=[O:21])[C@H:14]1[CH2:7]/[CH:5]=[CH:4]\[CH2:6][CH2:10][OH:20])[OH:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)8
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:136181
chebi:136181
TXHIPUZLOILIIU-RAJZRIHCSA-M 		L-isoleucine-(+)-12-hydroxy-7-isojasmonate
(+)-7-iso-12-hydroxyjasmonoyl-L-isoleucinate
(2S,3S)-2-(2-{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoate
(3R,7S)-12-OH-JA-Ile(1-)
(3R,7S)-12-hydroxyjasmonoyl-L-isoleucinate
N-({(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucinate
N-[(+)-12-hydroxy-7-isojasmonyl]-L-isoleucinate
N-[(+)-12-hydroxy-7-isojasmonyl]isoleucinate

metacyc.compound:CPD-13420
metacycM:CPD-13420
TXHIPUZLOILIIU-RAJZRIHCSA-M 		(+)-7-epi-12-hydroxyjasmonoyl-L-isoleucine
(+)-7-iso-12-hydroxyjasmonoyl-L-isoleucine
(3R,7S)-12-OH-JA-Ile
(3R,7S)-12-hydroxyjasmonoyl-L-isoleucine
(3R,7S)-12-hydroxyjasmonoyl-isoleucine

seed.compound:cpd23866
seedM:cpd23866
TXHIPUZLOILIIU-RAJZRIHCSA-M 		(3R, 7S)-12-OH-JA-Ile
(+)-7-epi-12-hydroxyjasmonoyl-L-isoleucine
(+)-7-iso-12-hydroxyjasmonoyl-L-isoleucine
(3R, 7S)-12-hydroxy-jasmonoyl-L-isoleucine
(3R, 7S)-12-hydroxyjasmonoyl-isoleucine
(3R,7S)-12-OH-JA-Ile
(3R,7S)-12-hydroxyjasmonoyl-L-isoleucine
(3R,7S)-12-hydroxyjasmonoyl-isoleucine

SLM:000597952
slm:000597952
TXHIPUZLOILIIU-RAJZRIHCSA-M 		L-isoleucine-( )-12-hydroxy-7-isojasmonate

CHEBI:137044
chebi:137044
TXHIPUZLOILIIU-RAJZRIHCSA-N 		N-[(+)-12-hydroxy-7-isojasmonyl]isoleucine
(+)-7-iso-12-hydroxyjasmonoyl-L-isoleucine
(2S,3S)-2-(2-{(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetamido)-3-methylpentanoic acid
(3R,7S)-12-OH-JA-Ile
(3R,7S)-12-hydroxyjasmonoyl-L-isoleucine
(3R,7S)-12-hydroxyjasmonoyl-isoleucine
12-OH-7-iso-JA-Ile
12-OH-7-iso-JA-L-Ile
7-iso-12-OH-JA-Ile
7-iso-12-OH-JA-L-Ile
N-({(1R,2S)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetyl)-L-isoleucine
N-[(3R,7S)-12-hydroxyjasmonyl]-L-isoleucine
N-tuberonyl-L-isoleucine
N-tuberonylisoleucine

chebi:136774
seedM:M_cpd23866 		secondary/obsolete/fantasy identifier