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GDP-3-dehydro-6-deoxy-alpha-D-mannose

MNXM148255 is deprecated and replaced by MNXM1100545
PropertiesImage
MNX_IDMNXM1100545 Image of MNXM1100545
referencemetacycM:CPD-17205
formulaC16H21N5O15P2
global charge-2
mol weight585.312
InChIKeyPMOXJGGMVHCPLX-RFJYTXHLSA-L
InChIInChI=1S/C16H23N5O15P2/c1-4-7(22)9(24)11(26)15(33-4)35-38(30,31)36-37(28,29)32-2-5-8(23)10(25)14(34-5)21-3-18-6-12(21)19-16(17)20-13(6)27/h3-5,7-8,10-11,14-15,22-23,25-26H,2H2,1H3,(H,28,29)(H,30,31)(H3,17,19,20,27)/p-2/t4-,5-,7-,8-,10-,11+,14-,15-/m1/s1
SMILESC[C@H]1O[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)[C@@H](O)C(=O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C16H23N5O15P2/c1-4-7(22)9(24)11(26)15(33-4)35-38(30,31)36-37(28,29)32-2-5-8(23)10(25)14(34-5)21-3-18-6-12(21)19-16(17)20-13(6)27/h3-5,7-8,10-11,14-15,22-23,25-26H,2H2,1H3,(H,28,29)(H,30,31)(H3,17,19,20,27)/t4-,5-,7-,8-,10-,11+,14-,15-/m1/s1 Image of MNXM1100545
SMILES (mnx)[CH3:1][C@@H:4]1[C@@H:7]([OH:22])[C:9](=[O:24])[C@H:11]([OH:26])[C@@H:15]([O:35][P:38]([OH:30])(=[O:31])[O:36][P:37]([OH:28])(=[O:29])[O:32][CH2:2][C@@H:5]2[C@@H:8]([OH:23])[C@@H:10]([OH:25])[C@H:14]([N:21]3[CH:3]=[N:18][C:6]4=[C:12]3[NH:19][C:16](=[NH:17])[N:20]=[C:13]4[OH:27])[O:34]2)[O:33]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

metacyc.compound:CPD-17205
metacycM:CPD-17205
PMOXJGGMVHCPLX-RFJYTXHLSA-L 		GDP-3-dehydro-6-deoxy-alpha-D-mannose
3-dehydro-6-deoxy-alpha-D-mannose
3-dehydro-6-deoxymannose
3-keto-6-deoxymannose
GDP-3-dehydro-6-deoxymannose
GDP-3-keto-6-deoxymannose

seed.compound:cpd32735
seedM:cpd32735
PMOXJGGMVHCPLX-RFJYTXHLSA-L 		GDP-3-dehydro-6-deoxy-alpha-D-mannose
GDP-3-dehydro-6-deoxymannose
GDP-3-keto-6-deoxymannose

seedM:M_cpd32735 		secondary/obsolete/fantasy identifier