化学式

CAS号

IUPAC Name

(1R,3S)-3-[[(3aR,5aR,5bR,7aR,9S,11aR,11bR,13aS)-3a-[[2-(chloroamino)-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-(chloroamino)-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/C41H63ClN2O6/c1-22(2)30-26(45)21-41(43-34(49)37(7,8)44-42)19-18-39(10)23(31(30)41)12-13-28-38(9)16-15-29(36(5,6)27(38)14-17-40(28,39)11)50-33(48)25-20-24(32(46)47)35(25,3)4/h22-25,27-29,44H,12-21H2,1-11H3,(H,43,49)(H,46,47)/t23-,24+,25-,27+,28-,29+,38+,39-,40-,41-/m1/s1

InChI Key

CRUNMBLVZWGMRE-QRLKSQBWSA-N

Canonical SMILES

CC(C)C1=C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CC1=O)NC(=O)C(C)(C)NCl)C)C)(C)C)OC(=O)C6CC(C6(C)C)C(=O)O)C

别名

• SCHEMBL18376049