(3β,16β,17α,18β,20α)-18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid

CAS Registry Number®

83-60-3

CAS Name

(3β,16β,17α,18β,20α)-18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid

Molecular Formula

C22H28N2O5

Molecular Mass

400.47

Cite this Page

(3β,16β,17α,18β,20α)-18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83-60-3 (retrieved 2024-11-22) (CAS RN: 83-60-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    242 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C22H28N2O5/c1-28-12-3-4-13-14-5-6-24-10-11-7-18(25)21(29-2)19(22(26)27)15(11)9-17(24)20(14)23-16(13)8-12/h3-4,8,11,15,17-19,21,23,25H,5-7,9-10H2,1-2H3,(H,26,27)/t11-,15+,17-,18-,19+,21+/m1/s1

InChIKey

InChIKey=JVHNBFFHWQQPLL-WOXROFTLSA-N

SMILES

C(O)(=O)[C@H]1[C@@]2([C@@](CN3[C@](C2)(C4=C(CC3)C=5C(N4)=CC(OC)=CC5)[H])(C[C@@H](O)[C@@H]1OC)[H])[H]

Canonical SMILES

O=C(O)C1C(OC)C(O)CC2CN3CCC=4C=5C=CC(OC)=CC5NC4C3CC12

Other Names for this Substance

  • Yohimban-16-carboxylic acid, 18-hydroxy-11,17-dimethoxy-, (3β,16β,17α,18β,20α)-
  • Reserpic acid
  • 3β,20α-Yohimban-16β-carboxylic acid, 18β-hydroxy-11,17α-dimethoxy-
  • (3β,16β,17α,18β,20α)-18-Hydroxy-11,17-dimethoxyyohimban-16-carboxylic acid
  • Reserpinolic acid

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