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Substance Name: Hesperidin methylchalcone
RN: 24292-52-2
UNII: 4T2GVA922X
InChIKey: FDHNLHLOJLLXDH-JIYHLSBYSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C29-H36-O15

Molecular Weight

  • 624.588
 
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Names and Synonyms

Name of Substance

  • Hesperidin methylchalcone

Synonyms

  • (E)-1-(4-((6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-hydroxy-6-methoxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)-2-propen-1-one
  • EINECS 246-128-2
  • Hesperidin methylchalcone
  • UNII-4T2GVA922X

Systematic Names

  • 1-(4-((6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-hydroxy-6-methoxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one
  • 2-Propen-1-one, 1-(4-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-hydroxy-6-methoxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)-, (2E)-
  • Chalcone, 2',3,4'-trihydroxy-4,6'-dimethoxy-, 4'-(6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside)

Registry Numbers

CAS Registry Number

  • 24292-52-2

FDA UNII

  • 4T2GVA922X

Other Registry Number

  • 25429-20-3

System Generated Number

  • 0024292522

Structure Descriptors

InChI

1S/C29H36O15/c1-12-22(33)24(35)26(37)28(42-12)41-11-20-23(34)25(36)27(38)29(44-20)43-14-9-17(32)21(19(10-14)40-3)15(30)6-4-13-5-7-18(39-2)16(31)8-13/h4-10,12,20,22-29,31-38H,11H2,1-3H3/b6-4+/t12-,20+,22-,23+,24+,25-,26+,27+,28+,29+/m0/s1

InChIKey

FDHNLHLOJLLXDH-JIYHLSBYSA-N

Smiles

O=C(\C=C\c1cc(c(OC)cc1)O)c1c(cc(cc1O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](CO[C@@H]2O[C@H]([C@H](O)[C@H](O)[C@H]2O)C)O1)O)O)O)OC