MPC-MECA (Q27087725)

CHEMBL2113610 (English)

3 October 2016

chemical formula

C₂₀H₂₄N₆O₅

1 reference

CHEMBL2113610 (English)

3 October 2016

canonical SMILES

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3NCC4=CC=C(C=C4)OC)O)O

1 reference

CHEMBL2113610 (English)

3 October 2016

isomeric SMILES

CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3NCC4=CC=C(C=C4)OC)O)O

1 reference

CHEMBL2113610 (English)

InChI=1S/C20H24N6O5/c1-3-21-19(29)16-14(27)15(28)20(31-16)26-10-25-13-17(23-9-24-18(13)26)22-8-11-4-6-12(30-2)7-5-11/h4-7,9-10,14-16,20,27-28H,3,8H2,1-2H3,(H,21,29)(H,22,23,24)/t14-,15+,16-,20+/m0/s1

3 October 2016

Identifiers

InChI

1 reference

CHEMBL2113610 (English)

BNXGNSTUSRFBCI-KSVNGYGVSA-N

3 October 2016

InChIKey

1 reference

CHEMBL2113610 (English)

3 October 2016

1 reference

(2S,3S,4R,5R)-N-Ethyl-3,4-dihydroxy-5-{6-[(4-methoxybenzyl)amino]-9H-purin-9-yl}tetrahydro-2-furancarboxamide (English)

3 October 2016

1 reference

CHEMBL2113610 (English)

3 October 2016

1 reference

Guide to Pharmacology Ligand ID

CHEMBL2113610 (English)

3 October 2016

1 reference

460

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

460