Brazilein

CAS Registry Number®

600-76-0

CAS Name

Brazilein

Molecular Formula

C16H12O5

Molecular Mass

284.26

Cite this Page

Brazilein.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=600-76-0 (retrieved 2025-01-30) (CAS RN: 600-76-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H12O5/c17-9-1-2-10-14(4-9)21-7-16(20)6-8-3-12(18)13(19)5-11(8)15(10)16/h1-5,17,19-20H,6-7H2

InChIKey

InChIKey=MLWIYODOURBGPI-UHFFFAOYSA-N

SMILES

OC12C(=C3C(C1)=CC(=O)C(O)=C3)C=4C(OC2)=CC(O)=CC4

Canonical SMILES

O=C1C=C2C(C=C1O)=C3C=4C=CC(O)=CC4OCC3(O)C2

Other Names for this Substance

  • Benz[b]indeno[1,2-d]pyran-9(6H)-one, 6a,7-dihydro-3,6a,10-trihydroxy-
  • 6a,7-Dihydro-3,6a,10-trihydroxybenz[b]indeno[1,2-d]pyran-9(6H)-one
  • Brazilein
  • Brasilein

Deleted or Replaced CAS Registry Numbers

26017-18-5