Mangiferin 6′-O-gallate

CAS Registry Number®

92631-82-8
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CAS Name

Mangiferin 6′-O-gallate

Molecular Formula

C26H22O15

Molecular Mass

574.44

Cite this Page

Mangiferin 6′-O-gallate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=92631-82-8 (retrieved 2024-09-19) (CAS RN: 92631-82-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H22O15/c27-9-3-8-14(4-10(9)28)40-15-5-11(29)17(22(35)18(15)19(8)32)25-24(37)23(36)21(34)16(41-25)6-39-26(38)7-1-12(30)20(33)13(31)2-7/h1-5,16,21,23-25,27-31,33-37H,6H2/t16-,21-,23+,24-,25+/m1/s1

InChIKey

InChIKey=PIAVWKNSDNBFSQ-QAAFULBCSA-N

SMILES

OC1=C2C(OC=3C(C2=O)=CC(O)=C(O)C3)=CC(O)=C1[C@@H]4O[C@H](COC(=O)C5=CC(O)=C(O)C(O)=C5)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C(OCC1OC(C2=C(O)C=C3OC4=CC(O)=C(O)C=C4C(=O)C3=C2O)C(O)C(O)C1O)C5=CC(O)=C(O)C(O)=C5

Other Names for this Substance

  • 9H-Xanthen-9-one, 1,3,6,7-tetrahydroxy-2-[6-O-(3,4,5-trihydroxybenzoyl)-β-D-glucopyranosyl]-
  • Benzoic acid, 3,4,5-trihydroxy-, 6′-ester with 2-β-D-glucopyranosyl-1,3,6,7-tetrahydroxy-9H-xanthen-9-one
  • 1,3,6,7-Tetrahydroxy-2-[6-O-(3,4,5-trihydroxybenzoyl)-β-D-glucopyranosyl]-9H-xanthen-9-one
  • Mangiferin 6′-O-gallate