Analyte Name

Yohimbine acetate hydrochloride

CAS Number

14430-18-3

Molecular Formula

C23H28N2O4 • HCl

Molecular Weight

432.95

Accurate Mass

432.18

SMILES

[H][C@](N1CC2)(C[C@@]([C@@H](C(OC)=O)[C@@H](OC(C)=O)CC3)([H])[C@]3([H])C1)C4=C2C(C=CC=C5)=C5N4.Cl

InChI

InChI=1S/C23H28N2O4.ClH/c1-13(26)29-20-8-7-14-12-25-10-9-16-15-5-3-4-6-18(15)24-22(16)19(25)11-17(14)21(20)23(27)28-2;/h3-6,14,17,19-21,24H,7-12H2,1-2H3;1H/t14-,17-,19-,20?,21+;/m0./s1

IUPAC

methyl (1R,2S,4aR,13bS,14aS)-2-acetoxy-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydroindolo[2',3':3,4]pyrido[1,2-b]isoquinoline-1-carboxylate hydrochloride

Alternate CAS Number

Free form: 15471-41-7

Country of Origin

CANADA

Product Format

Neat