化学式

CAS号

IUPAC Name

(1R,3S)-3-[[(3aR,5aR,5bR,7aR,9S,11aR,11bR,13aS)-3a-[[2-[[(3S)-1-氯哌啶-3-羰基]氨基]-2-甲基丙酰基]氨基]-5a,5b,8,8,11a-五甲基-2-氧代-1-丙烷-2-基-4,5,6,7,7a,9,10,11,11b,12,13,13a-十二氢-3H-环戊并[a]chrysen-9-基]oxycarbonyl]-2,2-二甲基环丁烷-1-羧酸 (1R,3S)-3-[[(3aR,5aR,5bR,7aR,9S,11aR,11bR,13aS)-3a-[[2-[[(3S)-1-chloropiperidine-3-carbonyl]amino]-2-methylpropanoyl]amino]-5a,5b,8,8,11a-pentamethyl-2-oxo-1-propan-2-yl-4,5,6,7,7a,9,10,11,11b,12,13,13a-dodecahydro-3H-cyclopenta[a]chrysen-9-yl]oxycarbonyl]-2,2-dimethylcyclobutane-1-carboxylic acid

InChI

InChI=1S/C47H72ClN3O7/c1-26(2)35-31(52)24-47(50-40(57)43(7,8)49-37(53)27-13-12-22-51(48)25-27)21-20-45(10)28(36(35)47)14-15-33-44(9)18-17-34(42(5,6)32(44)16-19-46(33,45)11)58-39(56)30-23-29(38(54)55)41(30,3)4/h26-30,32-34H,12-25H2,1-11H3,(H,49,53)(H,50,57)(H,54,55)/t27-,28+,29-,30+,32-,33+,34-,44-,45+,46+,47+/m0/s1

InChI Key

QIWNVSOWZOOZTH-MZTRYEMESA-N

Canonical SMILES

CC(C)C1=C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CC1=O)NC(=O)C(C)(C)NC(=O)C6CCCN(C6)Cl)C)C)(C)C)OC(=O)C7CC(C7(C)C)C(=O)O)C

别名

• SCHEMBL18375872