Frangulin A

CAS Registry Number®

521-62-0
No image available.

CAS Name

Frangulin A

Molecular Formula

C21H20O9

Molecular Mass

416.38

Cite this Page

Frangulin A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=521-62-0 (retrieved 2024-05-14) (CAS RN: 521-62-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    228 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C21H20O9/c1-7-3-10-14(12(22)4-7)18(26)15-11(17(10)25)5-9(6-13(15)23)30-21-20(28)19(27)16(24)8(2)29-21/h3-6,8,16,19-24,27-28H,1-2H3/t8-,16-,19+,20+,21-/m0/s1

InChIKey

InChIKey=DTTVUKLWJFJOHO-FUCRAMRQSA-N

SMILES

O=C1C=2C(C(=O)C=3C1=CC(C)=CC3O)=C(O)C=C(O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)C2

Canonical SMILES

O=C1C2=CC(OC3OC(C)C(O)C(O)C3O)=CC(O)=C2C(=O)C4=C(O)C=C(C=C14)C

Other Names for this Substance

  • 9,10-Anthracenedione, 3-[(6-deoxy-α-L-mannopyranosyl)oxy]-1,8-dihydroxy-6-methyl-
  • Frangulin A
  • 3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1,8-dihydroxy-6-methyl-9,10-anthracenedione
  • Franguloside
  • Emodin-L-rhamnoside

Deleted or Replaced CAS Registry Numbers

100456-02-8, 30401-58-2

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