N-(CYCLOPROPYLMETHYL)-19-ISOPENTYLNOROVINOL HYDROCHLORIDE

53056-01-2

MFCD01727326

C30 H43 N O4 . Cl H

518.134

InChI=1S/C30H43NO4.ClH/c1-18(2)9-10-27(3,33)22-16-28-11-12-30(22,34-4)26-29(28)13-14-31(17-19-5-6-19)23(28)15-20-7-8-21(32)25(35-26)24(20)29;/h7-8,18-19,22-23,26,32-33H,5-6,9-17H2,1-4H3;1H/t22?,23-,26-,27-,28+,29?,30?;/m1./s1

InChIKey=VQJMAIZOEPPELO-PLUAJANGSA-N

CC(C)CC[C@](C)(C1C[C@]23CCC1([C@H]4C25CCN([C@@H]3Cc6c5c(c(cc6)O)O4)CC7CC7)OC)O.Cl

H bond donor:2

H bond acceptor:5

XLogP3:5.0

Bulk/Fine:F