d-Butaclamol

CAS Registry Number®

56245-67-1

CAS Name

d-Butaclamol

Molecular Formula

C25H31NO

Molecular Mass

361.52

Cite this Page

d-Butaclamol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=56245-67-1 (retrieved 2024-11-22) (CAS RN: 56245-67-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H31NO/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25/h4-10,21-22,27H,11-16H2,1-3H3/t21-,22-,25-/m0/s1

InChIKey

InChIKey=ZZJYIKPMDIWRSN-HWBMXIPRSA-N

SMILES

C(C)(C)(C)[C@@]1(O)C[C@]2(C=3C=4[C@](C=5C(CCC4C=CC3)=CC=CC5)(CN2CC1)[H])[H]

Canonical SMILES

OC1(CCN2CC3C=4C=CC=CC4CCC5=CC=CC(=C53)C2C1)C(C)(C)C

Other Names for this Substance

  • 1H-Benzo[6,7]cyclohepta[1,2,3-de]pyrido[2,1-a]isoquinolin-3-ol, 3-(1,1-dimethylethyl)-2,3,4,4a,8,9,13b,14-octahydro-, (3S,4aS,13bS)-
  • 1H-Benzo[6,7]cyclohepta[1,2,3-de]pyrido[2,1-a]isoquinolin-3-ol, 3-(1,1-dimethylethyl)-2,3,4,4a,8,9,13b,14-octahydro-, [3S-(3α,4aα,13bβ)]-
  • (3S,4aS,13bS)-3-(1,1-Dimethylethyl)-2,3,4,4a,8,9,13b,14-octahydro-1H-benzo[6,7]cyclohepta[1,2,3-de]pyrido[2,1-a]isoquinolin-3-ol
  • (+)-Butaclamol
  • d-Butaclamol

CAS INSIGHTSTM
Targeted protein degrader structure, illustration