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Dehydroshikimic acid

PropertiesImage
MNX_IDMNXM1128984 Image of MNXM1128984
referencechebi:167871
formulaC7H8O5
global charge0
mol weight172.136
InChIKeyXNEFHYFPRJBTJF-UHFFFAOYSA-N
InChIInChI=1S/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4,6,8,10H,2H2,(H,11,12)
SMILESO=C(O)C1=CC(O)C(O)C(=O)C1
MNX internals
InChI (mnx)InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4,6,8,10H,2H2,(H,11,12)/t4?,6? Image of MNXM1128984
SMILES (mnx)[CH:1]1=[C:3]([C:7](=[O:11])[OH:12])[CH2:2][C:5](=[O:9])[CH:6]([OH:10])[CH:4]1[OH:8]
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:167871
chebi:167871
XNEFHYFPRJBTJF-UHFFFAOYSA-N
Dehydroshikimic acid
3,4-dihydroxy-5-oxocyclohexene-1-carboxylic acid

envipath:...32208914cb30
envipathM:...32208914cb30
XNEFHYFPRJBTJF-UHFFFAOYSA-M
compound 0283564