Pseudohypericin

CAS Registry Number®

55954-61-5

CAS Name

Pseudohypericin

Molecular Formula

C30H16O9

Molecular Mass

520.44

Cite this Page

Pseudohypericin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=55954-61-5 (retrieved 2024-11-22) (CAS RN: 55954-61-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H16O9/c1-7-2-9(32)19-23-15(7)16-8(6-31)3-10(33)20-24(16)28-26-18(12(35)5-14(37)22(26)30(20)39)17-11(34)4-13(36)21(29(19)38)25(17)27(23)28/h2-5,31-37H,6H2,1H3

InChIKey

InChIKey=YXBUQQDFTYOHQI-UHFFFAOYSA-N

SMILES

C(O)C1=C2C=3C4=C5C=6C2=C(C)C=C(O)C6C(=O)C7=C5C(C=8C4=C(C(=O)C3C(O)=C1)C(O)=CC8O)=C(O)C=C7O

Canonical SMILES

O=C1C2=C(O)C=C(O)C3=C4C(O)=CC(O)=C5C(=O)C=6C(O)=CC(=C7C6C(=C54)C(=C23)C=8C1=C(O)C=C(C87)C)CO

Other Names for this Substance

  • Phenanthro[1,10,9,8-opqra]perylene-7,14-dione, 1,3,4,6,8,13-hexahydroxy-10-(hydroxymethyl)-11-methyl-, stereoisomer
  • Pseudohypericin
  • 1,3,4,6,8,13-Hexahydroxy-10-(hydroxymethyl)-11-methylphenanthro[1,10,9,8-opqra]perylene-7,14-dione stereoisomer

Deleted or Replaced CAS Registry Numbers

54462-48-5, 345224-63-7

CAS INSIGHTSTM
Targeted protein degrader structure, illustration