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(-)-abscisic acid

PropertiesImage
MNX_IDMNXM30240 Image of MNXM30240
referencechebi:28937
formulaC15H20O4
global charge0
mol weight264.321
InChIKeyJLIDBLDQVAYHNE-QHFMCZIYSA-N
InChIInChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m0/s1
SMILESCC1=CC(=O)CC(C)(C)[C@]1(O)/C=C/C(C)=C\C(=O)O
MNX internals
InChI (mnx)InChI=1/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m0/s1 Image of MNXM30240
SMILES (mnx)[CH3:1][C:10](/[CH:5]=[CH:6]/[C@:15]1([OH:19])[C:11]([CH3:2])=[CH:8][C:12](=[O:16])[CH2:9][C:14]1([CH3:3])[CH3:4])=[CH:7]/[C:13](=[O:17])[OH:18]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:28937
chebi:28937
lipidmaps:LMPR0103050008
lipidmapsM:LMPR0103050008
JLIDBLDQVAYHNE-QHFMCZIYSA-N 		(-)-abscisic acid
(-)-ABA
(-)-Abscisic acid
(2Z,4E)-5-[(1R)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid
(7E,9Z)-(6R)-6-hydroxy-3-oxo-11-apo-epsilon-caroten-11-oic acid
(R)-abscisic acid

seed.compound:cpd19103
seedM:cpd19103
kegg.compound:C11060
keggC:C11060
JLIDBLDQVAYHNE-QHFMCZIYSA-M
JLIDBLDQVAYHNE-QHFMCZIYSA-N 		(-)-Abscisic acid
(-)-ABA

chebi:18679
chebi:18769
chebi:72
keggC:M_C11060
seedM:M_cpd19103 		secondary/obsolete/fantasy identifier