Isositsirikine

CAS Registry Number®

6519-27-3

CAS Name

Isositsirikine

Molecular Formula

C21H26N2O3

Molecular Mass

354.44

Cite this Page

Isositsirikine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6519-27-3 (retrieved 2024-11-22) (CAS RN: 6519-27-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    263.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H26N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,16-17,19,22,24H,8-12H2,1-2H3/b13-3-/t16-,17-,19-/m0/s1

InChIKey

InChIKey=RGXKJLTVROJBKZ-LZNZQLKFSA-N

SMILES

[C@H](C(OC)=O)(CO)[C@]/1(C[C@]2(C3=C(C=4C(N3)=CC=CC4)CCN2C\C1=C\C)[H])[H]

Canonical SMILES

O=C(OC)C(CO)C1C(=CC)CN2CCC=3C=4C=CC=CC4NC3C2C1

Other Names for this Substance

  • Indolo[2,3-a]quinolizine-2-acetic acid, 3-ethylidene-1,2,3,4,6,7,12,12b-octahydro-α-(hydroxymethyl)-, methyl ester, (αR,2R,3E,12bS)-
  • 17,18-Secoyohimban-16-carboxylic acid, 19,20-didehydro-17-hydroxy-, methyl ester, (16R,19E)-
  • Isositsirikine
  • Corynan-16-carboxylic acid, 19,20-didehydro-17-hydroxy-, methyl ester, (16R,19E)-
  • 16R-Isositsirikine

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration