Jerantinine B

CAS Registry Number®

1067224-91-2

CAS Name

Jerantinine B

Molecular Formula

C22H26N2O5

Molecular Mass

398.45

Cite this Page

Jerantinine B.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1067224-91-2 (retrieved 2024-11-22) (CAS RN: 1067224-91-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    235-237 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H26N2O5/c1-4-21-9-11(19(26)28-3)17-22(5-6-24(20(21)22)10-16-18(21)29-16)12-7-14(25)15(27-2)8-13(12)23-17/h7-8,16,18,20,23,25H,4-6,9-10H2,1-3H3/t16-,18-,20-,21+,22-/m0/s1

InChIKey

InChIKey=BECBFSXLBJGONE-DIMUUIPOSA-N

SMILES

C(C)[C@@]12[C@]3([C@@]4(C(=C(C(OC)=O)C1)NC=5C4=CC(O)=C(OC)C5)CCN3C[C@]6([C@@]2(O6)[H])[H])[H]

Canonical SMILES

O=C(OC)C1=C2NC3=CC(OC)=C(O)C=C3C24CCN5CC6OC6C(C1)(CC)C54

Other Names for this Substance

  • Aspidospermidine-3-carboxylic acid, 2,3-didehydro-6,7-epoxy-15-hydroxy-16-methoxy-, methyl ester, (5α,6α,7α,12R,19α)-
  • Jerantinine B
  • 10-Hydroxy-11-methoxytabersonine α-epoxide
  • Jerantinine A 14,15-α-epoxide

CAS INSIGHTSTM
Targeted protein degrader structure, illustration