2H-Pyran-5-carboxylic acid, 3-ethenyl-3,4-dihydro-2-hydroxy-4-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-, methyl ester, (2R,3R,4S)-

CAS Registry Number®

85925-13-9

CAS Name

2H-Pyran-5-carboxylic acid, 3-ethenyl-3,4-dihydro-2-hydroxy-4-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-, methyl ester, (2R,3R,4S)-

Molecular Formula

C21H24N2O4

Molecular Mass

368.43

Cite this Page

2H-Pyran-5-carboxylic acid, 3-ethenyl-3,4-dihydro-2-hydroxy-4-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-, methyl ester, (2R,3R,4S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=85925-13-9 (retrieved 2024-11-22) (CAS RN: 85925-13-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H24N2O4/c1-3-12-15(16(20(24)26-2)11-27-21(12)25)10-18-19-14(8-9-22-18)13-6-4-5-7-17(13)23-19/h3-7,11-12,15,18,21-23,25H,1,8-10H2,2H3/t12-,15+,18+,21-/m1/s1

InChIKey

InChIKey=HXLWDALZXJIPSY-LPIRWUFSSA-N

SMILES

C([C@H]1C2=C(C=3C(N2)=CC=CC3)CCN1)[C@@H]4C(C(OC)=O)=CO[C@@H](O)[C@@H]4C=C

Canonical SMILES

O=C(OC)C1=COC(O)C(C=C)C1CC2NCCC=3C=4C=CC=CC4NC32

Other Names for this Substance

  • 2H-Pyran-5-carboxylic acid, 3-ethenyl-3,4-dihydro-2-hydroxy-4-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-, methyl ester, (2R,3R,4S)-
  • 2H-Pyran-5-carboxylic acid, 3-ethenyl-3,4-dihydro-2-hydroxy-4-[(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)methyl]-, methyl ester, [2R-[2α,3β,4β(S*)]]-
  • 1H-Pyrido[3,4-b]indole, 2H-pyran-5-carboxylic acid deriv.
  • Strictosidine aglycone

CAS INSIGHTSTM
Targeted protein degrader structure, illustration