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7,8-Dihydroneopterin 3'-triphosphate

PropertiesImage
MNX_IDMNXM1369356 Image of MNXM1369356
referenceseedM:cpd02978
formulaC9H13N5O13P3
global charge-3
mol weight492.147
InChIKeyDAAXQXLWOSUXJM-SRBOSORUSA-K
InChIInChI=1S/C9H16N5O13P3/c10-9-13-7-5(8(17)14-9)12-3(1-11-7)6(16)4(15)2-25-29(21,22)27-30(23,24)26-28(18,19)20/h3-4,12,15H,1-2H2,(H,21,22)(H,23,24)(H2,18,19,20)(H4,10,11,13,14,17)/p-3/t3?,4-/m1/s1
SMILESNC1=NC(=O)C2=C(NCC(C(=O)[C@H](O)COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])O)N2)N1
MNX internals
InChI (mnx)InChI=1/C9H16N5O13P3/c10-9-13-7-5(8(17)14-9)12-3(1-11-7)6(16)4(15)2-25-29(21,22)27-30(23,24)26-28(18,19)20/h3-4,12,15H,1-2H2,(H,21,22)(H,23,24)(H2,18,19,20)(H4,10,11,13,14,17)/t3?,4-/m1/s1 Image of MNXM1369356
SMILES (mnx)[CH2:1]1[CH:3]([C:6]([C@@H:4]([CH2:2][O:25][P:29]([OH:21])(=[O:22])[O:27][P:30]([OH:23])(=[O:24])[O:26][P:28]([OH:18])([OH:19])=[O:20])[OH:15])=[O:16])[NH:12][C:5]2=[C:7]([NH:11]1)[NH:13][C:9](=[NH:10])[N:14]=[C:8]2[OH:17]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)13
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd02978
seedM:cpd02978
DAAXQXLWOSUXJM-SRBOSORUSA-K
7,8-Dihydroneopterin 3'-triphosphate
2-Amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)dihydropteridine triphosphate
2-Amino-4-hydroxy-6--erythro-1-2-3-trihydroxypropyldihydropteridinetriphosphate
2-amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)dihydropteridine triphosphate
6-(D-erythro-1',2',3'-trihydroxypropyl)-7,8-dihydropterin-3'-triphosphate
6-(L-erythro-1,2-Dihydroxypropyl 3-triphosphate)-7,8-dihydropterin
6-[(1S,2R)-1,2-Dihydroxy-3-triphosphooxypropyl]-7,8-dihydropterin
7,8-dihydroneopterin 3'-triphosphate
7,8-dihydroneopterin triphosphate
H2NTP
ahdt
dihydroneopterin triphosphate

seedM:M_cpd02978
secondary/obsolete/fantasy identifier