(-)-Quadrangularin A

CAS Registry Number®

252557-25-8

CAS Name

(-)-Quadrangularin A

Molecular Formula

C28H22O6

Molecular Mass

454.47

Cite this Page

(-)-Quadrangularin A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=252557-25-8 (retrieved 2024-12-18) (CAS RN: 252557-25-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H22O6/c29-18-5-1-15(2-6-18)9-23-24-13-22(33)14-25(34)28(24)27(16-3-7-19(30)8-4-16)26(23)17-10-20(31)12-21(32)11-17/h1-14,26-27,29-34H/b23-9-/t26-,27+/m0/s1

InChIKey

InChIKey=BIQMSWPBPAKGSE-PHPWSYFYSA-N

SMILES

C(=C/1\[C@@H]([C@H](C=2C1=CC(O)=CC2O)C3=CC=C(O)C=C3)C4=CC(O)=CC(O)=C4)\C5=CC=C(O)C=C5

Canonical SMILES

OC1=CC=C(C=C1)C=C2C=3C=C(O)C=C(O)C3C(C4=CC=C(O)C=C4)C2C=5C=C(O)C=C(O)C5

Other Names for this Substance

  • 1H-Indene-4,6-diol, 2-(3,5-dihydroxyphenyl)-2,3-dihydro-3-(4-hydroxyphenyl)-1-[(4-hydroxyphenyl)methylene]-, (1E,2S,3S)-
  • (1E,2S,3S)-2-(3,5-Dihydroxyphenyl)-2,3-dihydro-3-(4-hydroxyphenyl)-1-[(4-hydroxyphenyl)methylene]-1H-indene-4,6-diol
  • Quadrangularin A
  • (-)-Quadrangularin A

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