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(-)-carbovir

PropertiesImage
MNX_IDMNXM2746 Image of MNXM2746
referencechebi:421843
formulaC11H13N5O2
global charge0
mol weight247.258
InChIKeyXSSYCIGJYCVRRK-RQJHMYQMSA-N
InChIInChI=1S/C11H13N5O2/c12-11-14-9-8(10(18)15-11)13-5-16(9)7-2-1-6(3-7)4-17/h1-2,5-7,17H,3-4H2,(H3,12,14,15,18)/t6-,7+/m1/s1
SMILESNC1=NC2=C(N=CN2[C@H]2C=C[C@@H](CO)C2)C(=O)N1
MNX internals
InChI (mnx)InChI=1/C11H13N5O2/c12-11-14-9-8(10(18)15-11)13-5-16(9)7-2-1-6(3-7)4-17/h1-2,5-7,17H,3-4H2,(H3,12,14,15,18)/t6-,7+/m1/s1 Image of MNXM2746
SMILES (mnx)[CH:1]1=[CH:2][C@H:7]([N:16]2[CH:5]=[N:13][C:8]3=[C:9]2[NH:14][C:11](=[NH:12])[N:15]=[C:10]3[OH:18])[CH2:3][C@@H:6]1[CH2:4][OH:17]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:421843
chebi:421843
XSSYCIGJYCVRRK-RQJHMYQMSA-N 		(-)-carbovir
(1R-cis)-2-amino-1,9-dihydro-9-(4-(hydroxymethyl)-2-cyclopenten-1-yl)-6H-purin-6-one
2-amino-9-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-1,9-dihydro-6H-purin-6-one
2-amino-9-[(1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-9H-purin-6-ol
CBV
carbovir
hmdb:HMDB0242235
XSSYCIGJYCVRRK-UHFFFAOYSA-N 		(+-)-Carbovir
2-amino-9-[4-(hydroxymethyl)cyclopent-2-en-1-yl]-1H-purin-6-one
2-amino-9-[4-(hydroxymethyl)cyclopent-2-en-1-yl]-6,9-dihydro-1H-purin-6-one

reactome:R-ALL-2161514
reactomeM:R-ALL-2161514 		carbovir
(-)-carbovir
xenobiotic