TTD Drug ID: DNC000374

Drug Information
Name	C2-MAD
Indication	Not Available			Experimental
Structure	Click to save drug structure in 3D MOL format Click to save drug structure in 2D MOL format
InChI	1S/C23H29N5O13P2/c1-10-12-5-38-23(32)14(12)16(29)11(19(10)37-2)3- 4-39-42(33,34)9-43(35,36)40-6-13-17(30)18(31)22(41-13)28-8-27-15- 20(24)25-7-26-21(15)28/h7-8,13,17-18,22,29-31H,3-6,9H2,1-2H3,(H,3 3,34)(H,35,36)(H2,24,25,26)/t13-,17-,18-,22-/m1/s1
InChIKey	AMYUZLUBFKOUEX-JKWAKEATSA-N
Canonical SMILES	CC1=C(C(=C(C2=C1COC2=O)O)CCOP(=O)(CP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN= C5N)O)O)O)OC
Isomeric SMILES	CC1=C(C(=C(C2=C1COC2=O)O)CCOP(=O)(CP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H] (O3)N4C=NC5=C4N=CN=C5N)O)O)O)OC
PubChem Compound ID	CID 477579.
PubChem Substance ID	SID 635165.
Target	Inosine-5'-monophosphate dehydrogenase 2			Inhibitor	[1]
Ref 1	Novel mycophenolic adenine bis(phosphonate) analogues as potential differentiation agents against human leukemia. J Med Chem. 2002 Jan 31;45(3):703-12. To Reference

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