Neoruscogenin

CAS Registry Number®

17676-33-4

CAS Name

Neoruscogenin

Molecular Formula

C27H40O4

Molecular Mass

428.60

Cite this Page

Neoruscogenin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17676-33-4 (retrieved 2024-11-22) (CAS RN: 17676-33-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H40O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)13-21-19-6-5-17-11-18(28)12-23(29)26(17,4)20(19)8-9-25(21,24)3/h5,16,18-24,28-29H,1,6-14H2,2-4H3/t16-,18+,19+,20-,21-,22-,23+,24-,25-,26-,27+/m0/s1

InChIKey

InChIKey=ALTRINCJVPIQNK-NHIXJPGBSA-N

SMILES

C[C@@]12[C@@]3([C@@](O[C@@]4([C@H]3C)CCC(=C)CO4)(C[C@]1([C@]5([C@](CC2)([C@]6(C)C(=CC5)C[C@@H](O)C[C@H]6O)[H])[H])[H])[H])[H]

Canonical SMILES

OC1CC2=CCC3C(CCC4(C)C3CC5OC6(OCC(=C)CC6)C(C)C54)C2(C)C(O)C1

Other Names for this Substance

  • Spirosta-5,25(27)-diene-1,3-diol, (1β,3β)-
  • Spirosta-5,25(27)-diene-1β,3β-diol
  • Neoruscogenin
  • (1β,3β)-Spirosta-5,25(27)-diene-1,3-diol
  • 25(27)-Dehydroruscogenin

Deleted or Replaced CAS Registry Numbers

514-31-8, 1868133-59-8

CAS INSIGHTSTM
Targeted protein degrader structure, illustration