Mesobilirubin IXα

CAS Registry Number®

16568-56-2

CAS Name

Mesobilirubin IXα

Molecular Formula

C33H40N4O6

Molecular Mass

588.69

Cite this Page

Mesobilirubin IXα.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=16568-56-2 (retrieved 2024-11-21) (CAS RN: 16568-56-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    315-320 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C33H40N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h13-14,34-35H,7-12,15H2,1-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b26-13-,27-14-

InChIKey

InChIKey=HVHKMUMXERBUAN-IFADSCNNSA-N

SMILES

C(C1=C(CCC(O)=O)C(C)=C(/C=C\2/C(CC)=C(C)C(=O)N2)N1)C3=C(CCC(O)=O)C(C)=C(/C=C\4/C(C)=C(CC)C(=O)N4)N3

Canonical SMILES

O=C1NC(=CC=2NC(=C(C2C)CCC(=O)O)CC=3NC(C=C4NC(=O)C(=C4C)CC)=C(C3CCC(=O)O)C)C(=C1C)CC

Other Names for this Substance

  • 21H-Biline-8,12-dipropanoic acid, 2,17-diethyl-1,10,19,22,23,24-hexahydro-3,7,13,18-tetramethyl-1,19-dioxo-
  • Biline-8,12-dipropionic acid, 2,17-diethyl-1,10,19,22,23,24-hexahydro-3,7,13,18-tetramethyl-1,19-dioxo-
  • 2,17-Diethyl-1,10,19,22,23,24-hexahydro-3,7,13,18-tetramethyl-1,19-dioxo-21H-biline-8,12-dipropanoic acid
  • Mesobilirubin IXα
  • Mesobilirubin

Deleted or Replaced CAS Registry Numbers

493-85-6, 873376-86-4, 939889-24-4

CAS INSIGHTSTM
Targeted protein degrader structure, illustration