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GDP-N-acetyl-alpha-D-perosamine

MNXM146396 is deprecated and replaced by MNXM1100365
PropertiesImage
MNX_IDMNXM1100365 Image of MNXM1100365
referencechebi:73997
formulaC18H26N6O15P2
global charge-2
mol weight628.381
InChIKeyQYYLCPNKZRMSFL-XEDXKBCUSA-L
InChIInChI=1S/C18H28N6O15P2/c1-5-8(21-6(2)25)11(27)13(29)17(36-5)38-41(33,34)39-40(31,32)35-3-7-10(26)12(28)16(37-7)24-4-20-9-14(24)22-18(19)23-15(9)30/h4-5,7-8,10-13,16-17,26-29H,3H2,1-2H3,(H,21,25)(H,31,32)(H,33,34)(H3,19,22,23,30)/p-2/t5-,7-,8-,10-,11+,12-,13+,16-,17-/m1/s1
SMILESCC(=O)N[C@H]1[C@H](O)[C@H](O)[C@@H](OP(=O)([O-])OP(=O)([O-])OC[C@H]2O[C@@H](N3C=NC4=C3N=C(N)NC4=O)[C@H](O)[C@@H]2O)O[C@@H]1C
MNX internals
InChI (mnx)InChI=1/C18H28N6O15P2/c1-5-8(21-6(2)25)11(27)13(29)17(36-5)38-41(33,34)39-40(31,32)35-3-7-10(26)12(28)16(37-7)24-4-20-9-14(24)22-18(19)23-15(9)30/h4-5,7-8,10-13,16-17,26-29H,3H2,1-2H3,(H,21,25)(H,31,32)(H,33,34)(H3,19,22,23,30)/t5-,7-,8-,10-,11+,12-,13+,16-,17-/m1/s1 Image of MNXM1100365
SMILES (mnx)[CH3:1][C@@H:5]1[C@@H:8]([N:21]=[C:6]([CH3:2])[OH:25])[C@H:11]([OH:27])[C@H:13]([OH:29])[C@@H:17]([O:38][P:41]([OH:33])(=[O:34])[O:39][P:40]([OH:31])(=[O:32])[O:35][CH2:3][C@@H:7]2[C@@H:10]([OH:26])[C@@H:12]([OH:28])[C@H:16]([N:24]3[CH:4]=[N:20][C:9]4=[C:14]3[NH:22][C:18](=[NH:19])[N:23]=[C:15]4[OH:30])[O:37]2)[O:36]1
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:73997
chebi:73997
QYYLCPNKZRMSFL-XEDXKBCUSA-L 		GDP-N-acetyl-alpha-D-perosamine
GDP-4-acetamido-4,6-dideoxy-alpha-D-mannose(2-)
GDP-N-acetyl-alpha-D-perosamine(2-)
guanosine 5'-[3-(4-acetamido-4,6-dideoxy-alpha-D-mannopyranose) diphosphate]

seed.compound:cpd31269
seedM:cpd31269
QYYLCPNKZRMSFL-XEDXKBCUSA-L 		GDP-4-acetamido-4,6-dideoxy-alpha-D-mannose
GDP-4-acetamido-4-amino-4,6-dideoxy-alpha-D-mannose
GDP-N-acetyl-alpha-D-perosamine

kegg.compound:C20672
keggC:C20672
QYYLCPNKZRMSFL-XEDXKBCUSA-N 		GDP-4-acetamido-4,6-dideoxy-alpha-D-mannose
GDP-N-acetyl-alpha-D-perosamine

metacyc.compound:CPD-15537
metacycM:CPD-15537
QYYLCPNKZRMSFL-XEDXKBCUSA-L 		GDP-N-acetyl-alpha-D-perosamine
GDP-4-acetamido-4,6-dideoxy-alpha-D-mannose
GDP-4-acetamido-4-deoxy-alpha-D-rhamnose
GDP-D-Rha4NAc

CHEBI:74047
chebi:74047
QYYLCPNKZRMSFL-XEDXKBCUSA-N 		GDP-N-acetyl-alpha-D-perosamine
GDP-4-acetamido-4,6-dideoxy-alpha-D-mannose
guanosine 5'-[3-(4-acetamido-4,6-dideoxy-alpha-D-mannopyranose) dihydrogen diphosphate]

keggC:M_C20672
seedM:M_cpd31269 		secondary/obsolete/fantasy identifier