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7,8-dihydroneopterin 2',3'-cyclic phosphate

MNXM3197 is deprecated and here replaced by MNXM1369076
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1369076 Image of MNXM1369076
referencechebi:58854
formulaC9H11N5O6P
global charge-1
mol weight316.19
InChIKeyQXDMVWOCXHMTPE-XINAWCOVSA-M
InChIInChI=1S/C9H12N5O6P/c10-9-13-7-5(8(16)14-9)12-3(1-11-7)6(15)4-2-19-21(17,18)20-4/h4,6,15H,1-2H2,(H,17,18)(H4,10,11,13,14,16)/p-1/t4-,6+/m1/s1
SMILESNC1=NC2=C(N=C([C@H](O)[C@H]3COP(=O)([O-])O3)CN2)C(=O)N1
MNX internals
InChI (mnx)InChI=1/C9H12N5O6P/c10-9-13-7-5(8(16)14-9)12-3(1-11-7)6(15)4-2-19-21(17,18)20-4/h4,6,15H,1-2H2,(H,17,18)(H4,10,11,13,14,16)/t4-,6+/m1/s1 Image of MNXM1369076
SMILES (mnx)[CH2:1]1[C:3]([C@@H:6]([C@H:4]2[CH2:2][O:19][P:21]([OH:17])(=[O:18])[O:20]2)[OH:15])=[N:12][C:5]2=[C:7]([NH:11]1)[NH:13][C:9](=[NH:10])[N:14]=[C:8]2[OH:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58854
chebi:58854
QXDMVWOCXHMTPE-XINAWCOVSA-M 		7,8-dihydroneopterin 2',3'-cyclic phosphate
(4R)-4-[(S)-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)(hydroxy)methyl]-1,3,2-dioxaphospholan-2-olate 2-oxide
(4R)-4-[(S)-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)(hydroxy)methyl]-2-oxo-1,3,2lambda(5)-dioxaphospholan-2-olate
7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1-)

kegg.compound:C20567
keggC:C20567
QXDMVWOCXHMTPE-XINAWCOVSA-N 		7,8-Dihydroneopterin 2',3'-cyclic phosphate

CHEBI:50972
chebi:50972
QXDMVWOCXHMTPE-XINAWCOVSA-N 		7,8-dihydro-D-neopterin 2',3'-cyclic phosphate
2-amino-6-{(S)-hydroxy[(4R)-2-hydroxy-2-oxo-1,3,2-dioxaphospholan-4-yl]methyl}-7,8-dihydropteridin-4(3H)-one
7,8-dihydro-D-neopterin 2',3'-(dihydrogen phosphate)
7,8-dihydro-D-neopterin 2',3'-cyclic (dihydrogen phosphate)
7,8-dihydro-D-neopterin 2',3'-phosphate

metacyc.compound:CPD-10812
metacycM:CPD-10812
QXDMVWOCXHMTPE-XINAWCOVSA-M 		7,8-dihydroneopterin 2',3'-cyclic phosphate
7,8-dihydro-D-neopterin 2',3'-cyclic phosphate

keggC:M_C20567 		secondary/obsolete/fantasy identifier