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CMP-beta-3-deoxy-D-glycero-beta-D-galacto-non-2-ulopyranosonate

PropertiesImage
MNX_IDMNXM16753 Image of MNXM16753
referencechebi:90989
formulaC18H26N3O16P
global charge-2
mol weight571.385
InChIKeySFLGTPJBQWRIMH-ZBOJUINDSA-L
InChIInChI=1S/C18H28N3O16P/c19-9-1-2-21(17(31)20-9)15-13(28)12(27)8(35-15)5-34-38(32,33)37-18(16(29)30)3-6(23)10(25)14(36-18)11(26)7(24)4-22/h1-2,6-8,10-15,22-28H,3-5H2,(H,29,30)(H,32,33)(H2,19,20,31)/p-2/t6-,7+,8+,10+,11+,12+,13+,14+,15+,18+/m0/s1
SMILESNC1=NC(=O)N([C@@H]2O[C@H](COP(=O)([O-])O[C@@]3(C(=O)[O-])C[C@H](O)[C@@H](O)[C@H]([C@H](O)[C@H](O)CO)O3)[C@@H](O)[C@H]2O)C=C1
MNX internals
InChI (mnx)InChI=1/C18H28N3O16P/c19-9-1-2-21(17(31)20-9)15-13(28)12(27)8(35-15)5-34-38(32,33)37-18(16(29)30)3-6(23)10(25)14(36-18)11(26)7(24)4-22/h1-2,6-8,10-15,22-28H,3-5H2,(H,29,30)(H,32,33)(H2,19,20,31)/t6-,7+,8+,10+,11+,12+,13+,14+,15+,18+/m0/s1 Image of MNXM16753
SMILES (mnx)[CH:1]1=[CH:2][N:21]([C@H:15]2[C@H:13]([OH:28])[C@H:12]([OH:27])[C@@H:8]([CH2:5][O:34][P:38]([OH:32])(=[O:33])[O:37][C@@:18]3([C:16](=[O:29])[OH:30])[CH2:3][C@H:6]([OH:23])[C@@H:10]([OH:25])[C@H:14]([C@@H:11]([C@@H:7]([CH2:4][OH:22])[OH:24])[OH:26])[O:36]3)[O:35]2)[C:17]([OH:31])=[N:20][C:9]1=[NH:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:90989
chebi:90989
SFLGTPJBQWRIMH-ZBOJUINDSA-L 		CMP-beta-3-deoxy-D-glycero-beta-D-galacto-non-2-ulopyranosonate
CMP-3-deoxy-D-glycero-beta-D-galacto-nononate(2-)
CMP-3-deoxy-D-glycero-beta-D-galacto-nonulosonate(2-)
CMP-KDN(2-)
CMP-deaminoneuraminate

seed.compound:cpd22794
seedM:cpd22794
SFLGTPJBQWRIMH-ZBOJUINDSA-L 		CMP-2-keto-3-deoxy-D-glycero-D-galacto-nononate
CMP-2-keto-3-deoxy-D-glycero-D-galacto-nononic acid
CMP-3-deoxy-D-glycero-D-galacto-non-2-ulopyranosonate
CMP-3-deoxy-D-glycero-D-galacto-nononate
CMP-3-deoxy-D-glycero-D-galacto-nononic acid
CMP-3-deoxy-D-glycero-D-galacto-nonulosonate
CMP-3-deoxy-D-glycero-D-galacto-nonulosonic acid
CMP-KDN
CMP-Kdn
CMP-deaminoneuraminate
CMP-deaminoneuraminic acid

sabiork.compound:29615
sabiorkM:29615 		CMP-2-keto-3-deoxy-D-glycero-D-galacto-nononic acid
CMP-deaminoneuraminate

kegg.compound:C21384
keggC:C21384
SFLGTPJBQWRIMH-ZBOJUINDSA-N 		CMP-3-deoxy-D-glycero-D-galacto-non-2-ulopyranosonate
CMP-2-keto-3-deoxy-D-glycero-D-galacto-nononate
CMP-3-deoxy-D-glycero-beta-D-galacto-non-2-ulosonate
CMP-KDN

metacyc.compound:CPD-10737
metacycM:CPD-10737
SFLGTPJBQWRIMH-ZBOJUINDSA-L 		CMP-3-deoxy-D-glycero-D-galacto-non-2-ulopyranosonate
CMP-3-deoxy-D-glycero-D-galacto-nononate
CMP-3-deoxy-D-glycero-D-galacto-nononic acid
CMP-3-deoxy-D-glycero-D-galacto-nonulosonate
CMP-3-deoxy-D-glycero-D-galacto-nonulosonic acid
CMP-Kdn
CMP-deaminoneuraminate
CMP-deaminoneuraminic acid

CHEBI:131596
chebi:131596
SFLGTPJBQWRIMH-ZBOJUINDSA-N 		CMP-3-deoxy-D-glycero-beta-D-galacto-nonulosonic acid
CMP-3-deoxy-D-glycero-beta-D-galacto-nononic acid
CMP-KDN
CMP-deaminoneuraminic acid
cytidine 5'-[(3-deoxy-D-glycero-beta-D-galacto-non-2-ulopyranosonyl) hydrogen phosphate]

keggC:M_C21384
seedM:M_cpd22794 		secondary/obsolete/fantasy identifier