(2S,4S)-1-[[(8β)-9,10-Didehydro-6-methylergolin-8-yl]carbonyl]-2,4-dimethylazetidine

CAS Registry Number®

470666-31-0

CAS Name

(2S,4S)-1-[[(8β)-9,10-Didehydro-6-methylergolin-8-yl]carbonyl]-2,4-dimethylazetidine

Molecular Formula

C21H25N3O

Molecular Mass

335.44

Cite this Page

(2S,4S)-1-[[(8β)-9,10-Didehydro-6-methylergolin-8-yl]carbonyl]-2,4-dimethylazetidine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=470666-31-0 (retrieved 2024-10-08) (CAS RN: 470666-31-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H25N3O/c1-12-7-13(2)24(12)21(25)15-8-17-16-5-4-6-18-20(16)14(10-22-18)9-19(17)23(3)11-15/h4-6,8,10,12-13,15,19,22H,7,9,11H2,1-3H3/t12-,13-,15+,19+/m0/s1

InChIKey

InChIKey=DUKNIHFTDAXJON-CTQRGLTFSA-N

SMILES

CN1[C@]2(C(C=3C=4C(C2)=CNC4C=CC3)=C[C@@H](C(=O)N5[C@@H](C)C[C@@H]5C)C1)[H]

Canonical SMILES

O=C(N1C(C)CC1C)C2C=C3C=4C=CC=C5NC=C(C54)CC3N(C)C2

Other Names for this Substance

  • Azetidine, 1-[[(8β)-9,10-didehydro-6-methylergolin-8-yl]carbonyl]-2,4-dimethyl-, (2S,4S)-
  • (2S,4S)-1-[[(8β)-9,10-Didehydro-6-methylergolin-8-yl]carbonyl]-2,4-dimethylazetidine
  • LA-SS-Az
  • LSZ
  • Lysergic acid 2,4-dimethylazetidide

Deleted or Replaced CAS Registry Numbers

2137517-29-2

CAS INSIGHTSTM
© Nobel Prize Outreach. Photo: Hugh Fox