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compound 0225485

PropertiesImage
MNX_IDMNXM1186030 Image of MNXM1186030
referenceenvipathM:...b8d48a765439
formulaC13H11O6
global charge-1
mol weight263.225
InChIKeyGXZWWOMSWPRHMX-YVMONPNESA-M
InChIInChI=1S/C13H12O6/c14-9(12(17)13(18)19)5-8-6-3-1-2-4-7(6)10(15)11(8)16/h1-5,9-10,12,14-15,17H,(H,18,19)/p-1/b8-5-
SMILESO=C1/C(=C\C(O)C(O)C(=O)[O-])C2=C(C=CC=C2)C1O
MNX internals
InChI (mnx)InChI=1/C13H12O6/c14-9(12(17)13(18)19)5-8-6-3-1-2-4-7(6)10(15)11(8)16/h1-5,9-10,12,14-15,17H,(H,18,19)/b8-5-/t9?,10?,12? Image of MNXM1186030
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:7]2[C:6](=[CH:3]1)/[C:8](=[CH:5]/[CH:9]([CH:12]([C:13](=[O:18])[OH:19])[OH:17])[OH:14])[C:11](=[O:16])[CH:10]2[OH:15]
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

envipath:...b8d48a765439
envipathM:...b8d48a765439
GXZWWOMSWPRHMX-YVMONPNESA-M
compound 0225485