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2-keto-3-deoxy-D-glycero-D-galactononic acid 9-phosphate

PropertiesImage
MNX_IDMNXM9850 Image of MNXM9850
referencebiggM:kdnp
formulaC9H14O12P
global charge-3
mol weight345.173
InChIKeyONDNEVXIOCSZAT-IMSDGWMTSA-K
InChIInChI=1S/C9H17O12P/c10-3(1-4(11)9(16)17)6(13)8(15)7(14)5(12)2-21-22(18,19)20/h3,5-8,10,12-15H,1-2H2,(H,16,17)(H2,18,19,20)/p-3/t3-,5-,6+,7+,8+/m0/s1
SMILESO=C([O-])C(=O)C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)COP(=O)([O-])[O-]
MNX internals
InChI (mnx)InChI=1/C9H17O12P/c10-3(1-4(11)9(16)17)6(13)8(15)7(14)5(12)2-21-22(18,19)20/h3,5-8,10,12-15H,1-2H2,(H,16,17)(H2,18,19,20)/t3-,5-,6+,7+,8+/m0/s1 Image of MNXM9850
SMILES (mnx)[CH2:1]([C@@H:3]([C@H:6]([C@H:8]([C@@H:7]([C@H:5]([CH2:2][O:21][P:22]([OH:18])([OH:19])=[O:20])[OH:12])[OH:14])[OH:15])[OH:13])[OH:10])[C:4]([C:9]([OH:16])=[O:17])=[O:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:kdnp
biggM:kdnp
vmhM:kdnp
vmhmetabolite:kdnp
ONDNEVXIOCSZAT-IMSDGWMTSA-K
2-keto-3-deoxy-D-glycero-D-galactononic acid 9-phosphate

biggM:M_kdnp
vmhM:M_kdnp
secondary/obsolete/fantasy identifier