Products 3074962-67-4

CAS 3074962-67-4 is the registry number for TDP1 Inhibitor-3, 98.10%. Offered by: MedChemExpress. Available pack sizes: 10 mg, 50 mg, 5 mg, 25 mg, 100 mg.

Structural formula: {0} (CAS {1})

Methyl (4R)-4-[(3S,5R,8R,9S,10S,12S,13R,14S,17R)-3-(1,3-benzothiazol-2-ylsulfanylmethyl)-3,12-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate (CAS 3074962-67-4) is a chemical compound with the molecular formula C33H47NO4S2 and a molecular weight of 585.9 g/mol. IUPAC name: methyl (4R)-4-[(3S,5R,8R,9S,10S,12S,13R,14S,17R)-3-(1,3-benzothiazol-2-ylsulfanylmethyl)-3,12-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate. InChIKey: OWUNKVKTBJZCJX-NQWQHZCESA-N.

Identity
Molecular formulaC33H47NO4S2
Molecular weight585.9 g/mol
IUPAC namemethyl (4R)-4-[(3S,5R,8R,9S,10S,12S,13R,14S,17R)-3-(1,3-benzothiazol-2-ylsulfanylmethyl)-3,12-dihydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
InChIKeyOWUNKVKTBJZCJX-NQWQHZCESA-N
SMILESC[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@](C4)(CSC5=NC6=CC=CC=C6S5)O)C)O)C

Computed by PubChem (NCBI)

Synonyms: orb3033054