4H-1-Benzopyran-4-one, 3-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2-[4-[(6-deoxy-α-L-mannopyranosyl)oxy]-3-methoxyphenyl]-5,7-dihydroxy-

CAS Registry Number®

81053-13-6

CAS Name

4H-1-Benzopyran-4-one, 3-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2-[4-[(6-deoxy-α-L-mannopyranosyl)oxy]-3-methoxyphenyl]-5,7-dihydroxy-

Molecular Formula

C34H42O20

Molecular Mass

770.69

Cite this Page

4H-1-Benzopyran-4-one, 3-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2-[4-[(6-deoxy-α-L-mannopyranosyl)oxy]-3-methoxyphenyl]-5,7-dihydroxy-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81053-13-6 (retrieved 2024-11-22) (CAS RN: 81053-13-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C34H42O20/c1-10-20(37)24(41)27(44)32(49-10)48-9-18-22(39)26(43)29(46)34(53-18)54-31-23(40)19-14(36)7-13(35)8-17(19)51-30(31)12-4-5-15(16(6-12)47-3)52-33-28(45)25(42)21(38)11(2)50-33/h4-8,10-11,18,20-22,24-29,32-39,41-46H,9H2,1-3H3

InChIKey

InChIKey=YJJATMIYFDTODI-UHFFFAOYSA-N

SMILES

O(C1=C(OC=2C(C1=O)=C(O)C=C(O)C2)C3=CC(OC)=C(OC4C(O)C(O)C(O)C(C)O4)C=C3)C5OC(COC6C(O)C(O)C(O)C(C)O6)C(O)C(O)C5O

Canonical SMILES

O=C1C(OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2O)=C(OC=4C=C(O)C=C(O)C14)C=5C=CC(OC6OC(C)C(O)C(O)C6O)=C(OC)C5

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 3-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2-[4-[(6-deoxy-α-L-mannopyranosyl)oxy]-3-methoxyphenyl]-5,7-dihydroxy-
  • Isorhamnetin 3-rutinoside-4′-rhamnoside

CAS INSIGHTSTM
Targeted protein degrader structure, illustration