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(2E)-3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate

MNXM730955 is deprecated and here replaced by MNXM1371274
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1371274 Image of MNXM1371274
referencechebi:61451
formulaC9H9O4
global charge-1
mol weight181.167
InChIKeyAEUBLTTWYCDTGM-HXOXMVQHSA-M
InChIInChI=1S/C9H10O4/c10-7-3-1-2-6(9(7)13)4-5-8(11)12/h1-5,7,9-10,13H,(H,11,12)/p-1/b5-4+/t7-,9+/m0/s1
SMILESO=C([O-])/C=C/C1=CC=C[C@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C9H10O4/c10-7-3-1-2-6(9(7)13)4-5-8(11)12/h1-5,7,9-10,13H,(H,11,12)/b5-4+/t7-,9+/m0/s1 Image of MNXM1371274
SMILES (mnx)[CH:1]1=[CH:3][C@H:7]([OH:10])[C@H:9]([OH:13])[C:6](/[CH:4]=[CH:5]/[C:8](=[O:11])[OH:12])=[CH:2]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:61451
chebi:61451
AEUBLTTWYCDTGM-HXOXMVQHSA-M 		(2E)-3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate
(2E)-3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)acrylate
(2E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
(E)-3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate
(E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
(E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate anion
(E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate(1-)

CHEBI:61462
chebi:61462
AEUBLTTWYCDTGM-HXOXMVQHSA-N 		(E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid
(2E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]prop-2-enoic acid

seed.compound:cpd09253
seedM:cpd09253
AEUBLTTWYCDTGM-HXOXMVQHSA-M 		cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol
(2E)-3-(5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate
(2E)-3-(cis-5,6-Dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate
(2E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dien-1-yl]prop-2-enoate
3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate
cenchddd
cis-3-(3-carboxyethenyl)-3,5-cyclohexadiene-1,2-diol

kegg.compound:C12622
keggC:C12622
AEUBLTTWYCDTGM-HXOXMVQHSA-N 		cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol
(2E)-3-(cis-5,6-Dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate

keggC:M_C12622
seedM:M_cpd09253 		secondary/obsolete/fantasy identifier