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Ascorbalamic acid

PropertiesImage
MNX_IDMNXM119392 Image of MNXM119392
referencechebi:187178
formulaC9H13NO8
global charge0
mol weight263.202
InChIKeyFLVJBXHFHKVHJN-UHFFFAOYSA-N
InChIInChI=1S/C9H13NO8/c11-4-2-18-9(17,5(4)12)8(16)1-3(6(13)14)10-7(8)15/h3-5,11-12,16-17H,1-2H2,(H,10,15)(H,13,14)
SMILESO=C(O)C1CC(O)(C2(O)OCC(O)C2O)C(=O)N1
MNX internals
InChI (mnx)InChI=1/C9H13NO8/c11-4-2-18-9(17,5(4)12)8(16)1-3(6(13)14)10-7(8)15/h3-5,11-12,16-17H,1-2H2,(H,10,15)(H,13,14)/t3?,4?,5?,8?,9? Image of MNXM119392
SMILES (mnx)[CH2:1]1[CH:3]([C:6](=[O:13])[OH:14])[N:10]=[C:7]([OH:15])[C:8]1([C:9]1([OH:17])[CH:5]([OH:12])[CH:4]([OH:11])[CH2:2][O:18]1)[OH:16]
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:187178
chebi:187178
FLVJBXHFHKVHJN-UHFFFAOYSA-N
Ascorbalamic acid
4-hydroxy-5-oxo-4-(2,3,4-trihydroxyoxolan-2-yl)pyrrolidine-2-carboxylic acid
hmdb:HMDB0029944
FLVJBXHFHKVHJN-UHFFFAOYSA-N
Ascorbalamic acid
4,5-Dihydroxy-4-(2,3,4-trihydroxyoxolan-2-yl)-3,4-dihydro-2H-pyrrole-2-carboxylate
4,5-dihydroxy-4-(2,3,4-trihydroxyoxolan-2-yl)-2,3-dihydropyrrole-2-carboxylic acid
4,5-dihydroxy-4-(2,3,4-trihydroxyoxolan-2-yl)-3,4-dihydro-2H-pyrrole-2-carboxylic acid
Ascorbalamate

hmdb:HMDB29944
secondary/obsolete/fantasy identifier