Deserpidine

CAS Registry Number®

131-01-1
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CAS Name

Deserpidine

Molecular Formula

C32H38N2O8

Molecular Mass

578.65

Cite this Page

Deserpidine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=131-01-1 (retrieved 2024-04-18) (CAS RN: 131-01-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    230.5 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C32H38N2O8/c1-37-24-12-17(13-25(38-2)29(24)39-3)31(35)42-26-14-18-16-34-11-10-20-19-8-6-7-9-22(19)33-28(20)23(34)15-21(18)27(30(26)40-4)32(36)41-5/h6-9,12-13,18,21,23,26-27,30,33H,10-11,14-16H2,1-5H3/t18-,21+,23-,26-,27+,30+/m1/s1

InChIKey

InChIKey=CVBMAZKKCSYWQR-WCGOZPBSSA-N

SMILES

C(OC)(=O)[C@H]1[C@]2(C[C@@]3(C4=C(C=5C(N4)=CC=CC5)CCN3C[C@]2(C[C@@H](OC(=O)C6=CC(OC)=C(OC)C(OC)=C6)[C@@H]1OC)[H])[H])[H]

Canonical SMILES

O=C(OC1CC2CN3CCC=4C=5C=CC=CC5NC4C3CC2C(C(=O)OC)C1OC)C6=CC(OC)=C(OC)C(OC)=C6

Other Names for this Substance

  • Yohimban-16-carboxylic acid, 17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]-, methyl ester, (3β,16β,17α,18β,20α)-
  • 3β,20α-Yohimban-16β-carboxylic acid, 18β-hydroxy-17α-methoxy-, methyl ester, 3,4,5-trimethoxybenzoate (ester)
  • Deserpidine
  • Deserpidic acid, methyl ester, 3,4,5-trimethoxybenzoate
  • Benz[g]indolo[2,3-a]quinolizine, yohimban-16-carboxylic acid deriv.

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Deleted or Replaced CAS Registry Numbers

13079-12-4, 438621-53-5, 439669-81-5, 855395-45-8, 1195636-91-9

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