(11S,12R,12aS,13aS)-12-Ethenyl-11-(β-D-glucopyranosyloxy)-5,11,12,12a,13,13a-hexahydro-2-hydroxy-3-methoxy-6H,8H-benzo[a]pyrano[3,4-g]quinolizin-8-one

CAS Registry Number®

57128-91-3

CAS Name

(11S,12R,12aS,13aS)-12-Ethenyl-11-(β-D-glucopyranosyloxy)-5,11,12,12a,13,13a-hexahydro-2-hydroxy-3-methoxy-6H,8H-benzo[a]pyrano[3,4-g]quinolizin-8-one

Molecular Formula

C25H31NO10

Molecular Mass

505.51

Cite this Page

(11S,12R,12aS,13aS)-12-Ethenyl-11-(β-D-glucopyranosyloxy)-5,11,12,12a,13,13a-hexahydro-2-hydroxy-3-methoxy-6H,8H-benzo[a]pyrano[3,4-g]quinolizin-8-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57128-91-3 (retrieved 2024-11-22) (CAS RN: 57128-91-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H31NO10/c1-3-12-14-7-16-13-8-17(28)18(33-2)6-11(13)4-5-26(16)23(32)15(14)10-34-24(12)36-25-22(31)21(30)20(29)19(9-27)35-25/h3,6,8,10,12,14,16,19-22,24-25,27-31H,1,4-5,7,9H2,2H3/t12-,14+,16+,19-,20-,21+,22-,24+,25+/m1/s1

InChIKey

InChIKey=BCYNGTTVQNJTCV-ONGZBVEHSA-N

SMILES

O=C1N2[C@](C=3C(CC2)=CC(OC)=C(O)C3)(C[C@@]4(C1=CO[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H]4C=C)[H])[H]

Canonical SMILES

O=C1C2=COC(OC3OC(CO)C(O)C(O)C3O)C(C=C)C2CC4C5=CC(O)=C(OC)C=C5CCN14

Other Names for this Substance

  • 6H,8H-Benzo[a]pyrano[3,4-g]quinolizin-8-one, 12-ethenyl-11-(β-D-glucopyranosyloxy)-5,11,12,12a,13,13a-hexahydro-2-hydroxy-3-methoxy-, (11S,12R,12aS,13aS)-
  • 6H,8H-Benzo[a]pyrano[3,4-g]quinolizin-8-one, 12-ethenyl-11-(β-D-glucopyranosyloxy)-5,11,12,12a,13,13a-hexahydro-2-hydroxy-3-methoxy-, [11S-(11α,12β,12aα,13aβ)]-
  • (11S,12R,12aS,13aS)-12-Ethenyl-11-(β-D-glucopyranosyloxy)-5,11,12,12a,13,13a-hexahydro-2-hydroxy-3-methoxy-6H,8H-benzo[a]pyrano[3,4-g]quinolizin-8-one
  • Isoalangiside

CAS INSIGHTSTM
Targeted protein degrader structure, illustration