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Gossypin

CAS Registry Number®

652-78-8

CAS Name

Gossypin

Molecular Formula

C21H20O13

Molecular Mass

480.38

Cite this Page

Gossypin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=652-78-8 (retrieved 2024-12-26) (CAS RN: 652-78-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    230 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H20O13/c22-5-11-13(27)15(29)17(31)21(32-11)34-19-10(26)4-9(25)12-14(28)16(30)18(33-20(12)19)6-1-2-7(23)8(24)3-6/h1-4,11,13,15,17,21-27,29-31H,5H2/t11-,13-,15+,17-,21+/m1/s1

InChIKey

InChIKey=SJRXVLUZMMDCNG-KKPQBLLMSA-N

SMILES

O(C1=C2C(C(=O)C(O)=C(O2)C3=CC(O)=C(O)C=C3)=C(O)C=C1O)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C1C(O)=C(OC=2C(OC3OC(CO)C(O)C(O)C3O)=C(O)C=C(O)C12)C=4C=CC(O)=C(O)C4

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-8-(β-D-glucopyranosyloxy)-3,5,7-trihydroxy-
  • Gossypin
  • 2-(3,4-Dihydroxyphenyl)-8-(β-D-glucopyranosyloxy)-3,5,7-trihydroxy-4H-1-benzopyran-4-one
  • Gossypetin 8-glucoside

Deleted or Replaced CAS Registry Numbers

38681-84-4, 1343477-25-7

CAS INSIGHTSTM
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