3'-(4-Methoxy-1-piperidinyl)-3'-deaminodaunorubicin

9-acetyl-6,9,11-trihydroxy-10-[5-hydroxy-4-(4-methoxypiperidin-1-yl)-6-methyloxan-2-yl]oxy-1-methoxy-8,10-dihydro-7H-tetracene-5,12-dione

Also Known As: MOPDAD|3'-(4-Methoxy-1-piperidinyl)-3'-deaminodaunorubicin|92843-EP2269997A2|92843-EP2274983A1|92843-EP2275422A1|92843-EP2280009A1|92843-EP2287153A1|92843-EP2289868A1|92843-EP2292593A2|92843-EP2298768A1|92843-EP2305649A1|9-acetyl-6,9,11-trihydroxy-10-[5-hydroxy-4-(4-methoxypiperidin-1-yl)-6-methyloxan-2-yl]oxy-1-methoxy-8,10-dihydro-7H-tetracene-5,12-dione|MEO|5,12-Naphthacenedione, 7,8,9,10-tetrahydro-8-acetyl-1-methoxy-10-((3-(4-methoxypiperidino)-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-6,8,11-trihydroxy-, (8S-cis)-|5,12-Naphthacenedione, 8-acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-(4-methoxy-1-piperidinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-, (8S-cis)-|2-Acetyl-2,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-(4-methoxypiperidin-1-yl)hexopyranoside

Molecular Formula	C33H39NO11
Molecular Weight	625.2523 g/mol
LogP	2.6
Topological Polar Surface Area	172.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	12
Rotatable Bonds	6
Exact Mass	625.2523
Monoisotopic Mass	625.2523
Heavy Atoms	45
Complexity	1130.0

Chemical Identifiers

CAS Number	79867-76-8
SMILES	CC1C(C(CC(O1)OC2C3=C(CCC2(C(=O)C)O)C(=C4C(=C3O)C(=O)C5=C(C4=O)C=CC=C5OC)O)N6CCC(CC6)OC)O
InChIKey	TZQVDNZZCLISPO-UHFFFAOYSA-N