(+)-7-epi-jasmonoyl-L-isoleucine

Chemical Formula:

C₁₈H₂₈NO₄

Molecular Weight:

322.423 Daltons

Monoisotopic Mass:

323.2096584245 Daltons

SMILES:

CCC=CCC1(C(=O)CCC1CC(NC(C(C)CC)C([O-])=O)=O)

InChI:

1S/C18H29NO4/c1-4-6-7-8-14-13(9-10-15(14)20)11-16(21)19-17(18(22)23)12(3)5-2/h6-7,12-14,17H,4-5,8-11H2,1-3H3,(H,19,21)(H,22,23)/p-1/b7-6-/t12-,13+,14-,17-/m0/s1

InChIKey:

IBZYPBGPOGJMBF-QPERPISQSA-M

Synonyms

(+)-7-iso-JA-L-Ile
(+)-7-iso-jasmonate-L-isoleucine
(+)-7-iso-jasmonic acid-L-isoleucine
(+)-7-iso-jasmonic acid-L-isoleucine conjugate
(+)-7-iso-jasmonyl-L-isoleucine
N-[(3R,7S)-(+)-7-iso-Jasmonoyl]-(S)-isoleucine
(3R,7S)-JA-L-Ile
(+)-7-iso-jasmonoyl-L-isoleucine

Databases

MetaCyc: CPD-11259

ChEBI: 136180

PubChem (CID): 54758681

Seed: cpd22920

MetaNetX: MNXM9351