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7-methylxanthosine

Properties

Image

with InChI numbering

Occurences in reactions

MNX_ID

MNXM2341

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₁₁H₁₅N₄O₆

charge

mass

299.263

reference

chebi:49310

InChIKey

SYPRQIWERSQQNL-KQYNXXCUSA-O

InChI

InChI=1S/C11H14N4O6/c1-14-3-15(8-5(14)9(19)13-11(20)12-8)10-7(18)6(17)4(2-16)21-10/h3-4,6-7,10,16-18H,2H2,1H3,(H-,12,13,19,20)/p+1/t4-,6-,7-,10-/m1/s1

SMILES

[CH3:1][n+:14]1[cH:3][n:15]([C@H:10]2[C@H:7]([OH:18])[C@H:6]([OH:17])[C@@H:4]([CH2:2][OH:16])[O:21]2)[c:8]2[c:5]1[c:9]([OH:19])[n:13][c:11]([O-:20])[n:12]2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:7-METHYLXANTHOSINE metacycM:7-METHYLXANTHOSINE CHEBI:49310 chebi:49310	7-methylxanthosine
sabiork.compound:31374 sabiorkM:31374 kegg.compound:C16352 keggC:C16352 vmhM:7mxtsn vmhM:7mxtsn vmhmetabolite:7mxtsn vmhmetabolite:7mxtsn	7-Methylxanthosine
seed.compound:cpd15068 seedM:cpd15068	7-Methylxanthosine 7-methylxanthosine
hmdb:HMDB0301918	7-Methylxanthosine 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-2,6-dioxo-1,3-dihydro-9lambda⁵-purin-9-ylium 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-9lambda⁵-purin-9-ylium
keggC:M_C16352 seedM:M_cpd15068	secondary/obsolete/fantasy identifier