Catalog Number:
AG00FEV1
Chemical Name:
2-Chloroadenosine-5'-carboxy-2',3'-acetonide
CAS Number:
72209-19-9
Molecular Formula:
C13H14ClN5O5
Molecular Weight:
355.7338
MDL Number:
MFCD19105554
IUPAC Name:
(3aR,4R,6S,6aS)-4-(6-amino-2-chloropurin-9-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carboxylic acid
InChI:
InChI=1S/C13H14ClN5O5/c1-13(2)23-5-6(24-13)10(22-7(5)11(20)21)19-3-16-4-8(15)17-12(14)18-9(4)19/h3,5-7,10H,1-2H3,(H,20,21)(H2,15,17,18)/t5-,6+,7-,10+/m0/s1
InChI Key:
AAIOFNJSAFFWKY-HEZDBXPZSA-N
SMILES:
OC(=O)[C@H]1O[C@H]([C@H]2[C@@H]1OC(O2)(C)C)n1cnc2c1nc(Cl)nc2N
