Analyte Name

3-Dehydro Yohimbane Chloride

CAS Number

100625-39-6

Molecular Formula

C21 H25 N2 O3 . Cl

Molecular Weight

388.888

Accurate Mass

388.155

SMILES

[Cl-].COC(=O)[C@H]1[C@@H](O)CC[C@H]2C[N+]3=C(C[C@H]12)c4[nH]c5ccccc5c4CC3

InChI

InChI=1S/C21H24N2O3.ClH/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24;/h2-5,12,15,18-19,24H,6-11H2,1H3;1H/t12-,15-,18-,19+;/m0./s1

IUPAC

methyl (15R,18S,19R,20S)-18-hydroxy-11,12,14,15,16,17,18,19,20,21-decahydro-3H-yohimban-13-ium-19-carboxylate;chloride

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat