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deoxyviolaceinate

PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM1381156 Image of MNXM1381156 Image of MNXM1381156
#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
formulaC21H14N3O3
charge-1
mass356.361
referenceseedM:cpd24296
InChIKeyKOHOWMBWNFOZKD-UHFFFAOYSA-M
InChIInChI=1S/C21H15N3O3/c25-20-18(12-6-2-4-8-16(12)24-20)13-9-17(23-19(13)21(26)27)14-10-22-15-7-3-1-5-11(14)15/h1-10,18,22-23H,(H,24,25)(H,26,27)/p-1
SMILES[cH:1]1[cH:3][cH:7][c:15]2[c:11]([cH:5]1)[c:14](-[c:17]1[cH:9][c:13]([CH:18]3[c:12]4[cH:6][cH:2][cH:4][cH:8][c:16]4[N:24]=[C:20]3[OH:25])[c:19]([C:21]([OH:26])=[O:27])[nH:23]1)[cH:10][nH:22]2
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Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd24296
seedM:cpd24296
deoxyviolaceinate
deoxyviolaceinic acid
seedM:M_cpd24296 secondary/obsolete/fantasy identifier