Gossypitrin
CAS Registry Number®
489-34-9
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CAS Name
GossypitrinMolecular Formula
C21H20O13Molecular Mass
480.38Cite this Page
Gossypitrin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=489-34-9 (retrieved ) (CAS RN: 489-34-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
221-223 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C21H20O13/c22-5-11-13(26)16(29)18(31)21(33-11)32-10-4-9(25)12-15(28)17(30)19(34-20(12)14(10)27)6-1-2-7(23)8(24)3-6/h1-4,11,13,16,18,21-27,29-31H,5H2/t11-,13-,16+,18-,21-/m1/s1
InChIKey
InChIKey=ATRBFJXIWFCIMW-ZGNDCXKCSA-N
SMILES
OC1=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(OC2=C(O)C(OC3OC(CO)C(O)C(O)C3O)=CC(O)=C12)C=4C=CC(O)=C(O)C4
Other Names for this Substance
- 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-7-(β-D-glucopyranosyloxy)-3,5,8-trihydroxy-
- Gossypitrin
- 2-(3,4-Dihydroxyphenyl)-7-(β-D-glucopyranosyloxy)-3,5,8-trihydroxy-4H-1-benzopyran-4-one
- Equisporoside
- Gossypetin 7-β-D-glucopyranoside
Deleted or Replaced CAS Registry Numbers
27215-31-2
