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9-riburonosyladenine

PropertiesImage
MNX_IDMNXM2096 Image of MNXM2096
referencechebi:57605
formulaC10H10N5O5
global charge-1
mol weight280.22
InChIKeyIBYWUFHJUDTSOC-SOVPELCUSA-M
InChIInChI=1S/C10H11N5O5/c11-7-3-8(13-1-12-7)15(2-14-3)9-5(17)4(16)6(20-9)10(18)19/h1-2,4-6,9,16-17H,(H,18,19)(H2,11,12,13)/p-1/t4-,5+,6-,9+/m0/s1
SMILESNC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C10H11N5O5/c11-7-3-8(13-1-12-7)15(2-14-3)9-5(17)4(16)6(20-9)10(18)19/h1-2,4-6,9,16-17H,(H,18,19)(H2,11,12,13)/t4-,5+,6-,9+/m0/s1 Image of MNXM2096
SMILES (mnx)[CH:1]1=[N:12][C:7]([NH2:11])=[C:3]2[C:8](=[N:13]1)[N:15]([C@H:9]1[C@H:5]([OH:17])[C@H:4]([OH:16])[C@@H:6]([C:10](=[O:18])[OH:19])[O:20]1)[CH:2]=[N:14]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57605
chebi:57605
IBYWUFHJUDTSOC-SOVPELCUSA-M 		9-riburonosyladenine
1-(6-amino-9H-purin-9-yl)-1-deoxy-beta-D-ribofuranuronate
9-riburonosyladenine anion
adenin-9-yl riburonosate anion
adenin-9-yl riburonosate(1-)
adenosine 5'-carboxylate

kegg.compound:C11501
keggC:C11501
IBYWUFHJUDTSOC-SOVPELCUSA-N 		9-Riburonosyladenine

seed.compound:cpd08340
seedM:cpd08340
IBYWUFHJUDTSOC-SOVPELCUSA-M 		9-Riburonosyladenine
2-[(6-amino-4,9-dihydro-1H-purin-9-yl)]-4-hydroxy-5- (hydroxymethyl)tetrahydrofuran-3-one
9-riburonosyladenine
adenin-9-yl riburonosate

CHEBI:16009
chebi:16009
IBYWUFHJUDTSOC-SOVPELCUSA-N 		9-riburonosyladenine
1-(6-amino-9H-purin-9-yl)-1-deoxy-beta-D-ribofuranuronic acid
9-Riburonosyladenine
9-beta-D-ribofuranuronosyl-9H-purin-6-amine
9-beta-D-ribofuranuronosyladenine
Ado-5'-COOH
adenosine 5'-carboxylic acid
adenosine-5'-carboxylic acid

metacyc.compound:9-RIBURONOSYLADENINE
metacycM:9-RIBURONOSYLADENINE
IBYWUFHJUDTSOC-SOVPELCUSA-M 		adenin-9-yl riburonosate
2-[(6-amino-4,9-dihydro-1H-purin-9-yl)]-4-hydroxy-5- (hydroxymethyl)tetrahydrofuran-3-one
9-riburonosyladenine

envipath:...5cb1fbdba0e2
envipathM:...5cb1fbdba0e2
IBYWUFHJUDTSOC-SOVPELCUSA-M 		compound 0287408

chebi:12273
chebi:2337
keggC:M_C11501
seedM:M_cpd08340 		secondary/obsolete/fantasy identifier