Azalein

CAS Registry Number®

29028-02-2
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CAS Name

Azalein

Molecular Formula

C22H22O11

Molecular Mass

462.40

Cite this Page

Azalein.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=29028-02-2 (retrieved 2024-04-26) (CAS RN: 29028-02-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H22O11/c1-8-16(26)18(28)19(29)22(31-8)33-21-17(27)15-13(30-2)6-10(23)7-14(15)32-20(21)9-3-4-11(24)12(25)5-9/h3-8,16,18-19,22-26,28-29H,1-2H3/t8-,16-,18+,19+,22-/m0/s1

InChIKey

InChIKey=FYSMTINDJSASRR-UFGFRKJLSA-N

SMILES

O(C1=C(OC=2C(C1=O)=C(OC)C=C(O)C2)C3=CC(O)=C(O)C=C3)[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4

Canonical SMILES

O=C1C(OC2OC(C)C(O)C(O)C2O)=C(OC3=CC(O)=CC(OC)=C13)C=4C=CC(O)=C(O)C4

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 3-[(6-deoxy-α-L-mannopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-7-hydroxy-5-methoxy-
  • Azalein
  • Flavone, 3,3′,4′,7-tetrahydroxy-5-methoxy-, 3-rhamnoside
  • 3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-7-hydroxy-5-methoxy-4H-1-benzopyran-4-one
  • Azaleatin 3-rhamnoside

Deleted or Replaced CAS Registry Numbers

11027-97-7, 32760-17-1

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