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(E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate

PropertiesImage
MNX_IDMNXM1371275 Image of MNXM1371275
referencechebi:62057
formulaC9H9O4
global charge-1
mol weight181.167
InChIKeyAEUBLTTWYCDTGM-HZMPTLLJSA-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+/m1/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+/m1/s1 Image of MNXM1371275
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)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:62057
chebi:62057
AEUBLTTWYCDTGM-HZMPTLLJSA-M 		(E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate
(2E)-3-(5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate
(2E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]prop-2-enoate
3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate
cis-3-(3-carboxylatoethenyl)-3,5-cyclohexadiene-1,2-diol

metacyc.compound:CPD-13034
metacycM:CPD-13034
AEUBLTTWYCDTGM-HZMPTLLJSA-M 		(2E)-3-(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
cis-3-(3-carboxyethenyl)-3,5-cyclohexadiene-1,2-diol

CHEBI:62195
chebi:62195
AEUBLTTWYCDTGM-HZMPTLLJSA-N 		(E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylic acid
(2E)-3-(5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoic acid
(2E)-3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]prop-2-enoic acid
3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoic acid
cis-3-(3-carboxyethenyl)-3,5-cyclohexadiene-1,2-diol