7-[(6-Deoxy-α-L-mannopyranosyl)oxy]-3-[(O-β-D-glucopyranosyl-(1→2)-O-β-D-glucopyranosyl-(1→2)-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

CAS Registry Number®

50906-48-4

CAS Name

7-[(6-Deoxy-α-L-mannopyranosyl)oxy]-3-[(O-β-D-glucopyranosyl-(1→2)-O-β-D-glucopyranosyl-(1→2)-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

Molecular Formula

C39H50O25

Molecular Mass

918.80

Cite this Page

7-[(6-Deoxy-α-L-mannopyranosyl)oxy]-3-[(O-β-D-glucopyranosyl-(1→2)-O-β-D-glucopyranosyl-(1→2)-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=50906-48-4 (retrieved 2025-01-07) (CAS RN: 50906-48-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C39H50O25/c1-11-21(45)26(50)30(54)36(56-11)57-14-6-15(44)20-16(7-14)58-32(12-2-4-13(43)5-3-12)33(25(20)49)62-38-35(29(53)24(48)18(9-41)60-38)64-39-34(28(52)23(47)19(10-42)61-39)63-37-31(55)27(51)22(46)17(8-40)59-37/h2-7,11,17-19,21-24,26-31,34-48,50-55H,8-10H2,1H3/t11-,17+,18+,19+,21-,22+,23+,24+,26+,27-,28-,29-,30+,31+,34+,35+,36-,37-,38-,39-/m0/s1

InChIKey

InChIKey=BFCBWGVCQKVMCS-TYGYEQMNSA-N

SMILES

O(C1=C(OC=2C(C1=O)=C(O)C=C(O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)C2)C4=CC=C(O)C=C4)[C@H]5[C@H](O[C@H]6[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@@H](CO)O6)[C@@H](O)[C@H](O)[C@@H](CO)O5

Canonical SMILES

O=C1C(OC2OC(CO)C(O)C(O)C2OC3OC(CO)C(O)C(O)C3OC4OC(CO)C(O)C(O)C4O)=C(OC5=CC(OC6OC(C)C(O)C(O)C6O)=CC(O)=C15)C=7C=CC(O)=CC7

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 7-[(6-deoxy-α-L-mannopyranosyl)oxy]-3-[(O-β-D-glucopyranosyl-(1→2)-O-β-D-glucopyranosyl-(1→2)-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-
  • 7-[(6-Deoxy-α-L-mannopyranosyl)oxy]-3-[(O-β-D-glucopyranosyl-(1→2)-O-β-D-glucopyranosyl-(1→2)-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
  • Kaempferol 3-sophorotrioside 7-rhamnoside

Deleted or Replaced CAS Registry Numbers

663952-58-7

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