3,3′,4′,5,7-Pentabenzyloxyflavone

CAS Registry Number®

13157-90-9

CAS Name

3,3′,4′,5,7-Pentabenzyloxyflavone

Molecular Formula

C50H40O7

Molecular Mass

752.85

Cite this Page

3,3′,4′,5,7-Pentabenzyloxyflavone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13157-90-9 (retrieved 2024-11-21) (CAS RN: 13157-90-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    123-125 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C50H40O7/c51-48-47-45(55-34-39-22-12-4-13-23-39)29-42(52-31-36-16-6-1-7-17-36)30-46(47)57-49(50(48)56-35-40-24-14-5-15-25-40)41-26-27-43(53-32-37-18-8-2-9-19-37)44(28-41)54-33-38-20-10-3-11-21-38/h1-30H,31-35H2

InChIKey

InChIKey=CSQNIJRRXIHHAY-UHFFFAOYSA-N

SMILES

O(CC1=CC=CC=C1)C2=C3C(OC(=C(OCC4=CC=CC=C4)C3=O)C5=CC(OCC6=CC=CC=C6)=C(OCC7=CC=CC=C7)C=C5)=CC(OCC8=CC=CC=C8)=C2

Canonical SMILES

O=C1C(OCC=2C=CC=CC2)=C(OC3=CC(OCC=4C=CC=CC4)=CC(OCC=5C=CC=CC5)=C31)C=6C=CC(OCC=7C=CC=CC7)=C(OCC=8C=CC=CC8)C6

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2-[3,4-bis(phenylmethoxy)phenyl]-3,5,7-tris(phenylmethoxy)-
  • Flavone, 3,3′,4′,5,7-pentakis(benzyloxy)-
  • 2-[3,4-Bis(phenylmethoxy)phenyl]-3,5,7-tris(phenylmethoxy)-4H-1-benzopyran-4-one
  • 3,3′,4′,5,7-Pentabenzyloxyflavone
  • Benzquercine

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration