(14S,15aS,21S)-10,11,15,15a,16,17,18,19-Octahydro-2,3-dimethoxy-6,9-etheno-14,21-methano-12H,14H,21H-pyrido[2,1-l][1,9,13]benzodioxaazacyclohexadecin-12-one

CAS Registry Number®

14727-56-1

CAS Name

(14S,15aS,21S)-10,11,15,15a,16,17,18,19-Octahydro-2,3-dimethoxy-6,9-etheno-14,21-methano-12H,14H,21H-pyrido[2,1-l][1,9,13]benzodioxaazacyclohexadecin-12-one

Molecular Formula

C26H31NO5

Molecular Mass

437.53

Cite this Page

(14S,15aS,21S)-10,11,15,15a,16,17,18,19-Octahydro-2,3-dimethoxy-6,9-etheno-14,21-methano-12H,14H,21H-pyrido[2,1-l][1,9,13]benzodioxaazacyclohexadecin-12-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=14727-56-1 (retrieved 2024-11-22) (CAS RN: 14727-56-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H31NO5/c1-29-24-15-21-22-14-20(13-18-5-3-4-12-27(18)22)32-26(28)11-8-17-6-9-19(10-7-17)31-23(21)16-25(24)30-2/h6-7,9-10,15-16,18,20,22H,3-5,8,11-14H2,1-2H3/t18-,20-,22-/m0/s1

InChIKey

InChIKey=PXXNTAGJWPJAGM-VCOUNFBDSA-N

SMILES

O(C)C=1C=C2[C@]3(N4[C@](C[C@@](C3)(OC(=O)CCC=5C=CC(OC2=CC1OC)=CC5)[H])(CCCC4)[H])[H]

Canonical SMILES

O=C1OC2CC(C3=CC(OC)=C(OC)C=C3OC4=CC=C(C=C4)CC1)N5CCCCC5C2

Other Names for this Substance

  • 6,9-Etheno-14,21-methano-12H,14H,21H-pyrido[2,1-l][1,9,13]benzodioxaazacyclohexadecin-12-one, 10,11,15,15a,16,17,18,19-octahydro-2,3-dimethoxy-, (14S,15aS,21S)-
  • Decaline
  • 6,9-Etheno-14,21-methano-12H,14H,21H-pyrido[2,1-l][1,9,13]benzodioxaazacyclohexadecin-12-one, 10,11,15,15a,16,17,18,19-octahydro-2,3-dimethoxy-, [14S-(14R*,15aR*,21R*)]-
  • (14S,15aS,21S)-10,11,15,15a,16,17,18,19-Octahydro-2,3-dimethoxy-6,9-etheno-14,21-methano-12H,14H,21H-pyrido[2,1-l][1,9,13]benzodioxaazacyclohexadecin-12-one
  • 10-Epivertaline

View All

Deleted or Replaced CAS Registry Numbers

1356-47-4, 34490-81-8

CAS INSIGHTSTM
Targeted protein degrader structure, illustration