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Substance Name: Poncirin
RN: 14941-08-3
UNII: 8MUY4P95B4
InChIKey: NLAWPKPYBMEWIR-SKYQDXIQSA-N

Notes

  • Isolated from the fructus of Poncirus trifoliata.
  • Isolated from the fructus of Poncirus trifoliate.

Molecular Formula

  • C28-H34-O14

Molecular Weight

  • 594.5626
 
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Names and Synonyms

Results Name

  • Poncirin

Name of Substance

  • Poncirin

Synonyms

  • EINECS 239-020-1
  • Isosakuranetin-7-O-neohesperidoside
  • Poncirin
  • UNII-8MUY4P95B4

Systematic Name

  • (S)-7-((2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,3-dihydro-5-hydroxy-2-(4-methoxyphenyl)-4H-benzopyran-4-one

Registry Numbers

CAS Registry Number

  • 14941-08-3

FDA UNII

  • 8MUY4P95B4

System Generated Number

  • 0014941083

Structure Descriptors

InChI

1S/C28H34O14/c1-11-21(32)23(34)25(36)27(38-11)42-26-24(35)22(33)19(10-29)41-28(26)39-14-7-15(30)20-16(31)9-17(40-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-8,11,17,19,21-30,32-36H,9-10H2,1-2H3/t11-,17-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1

InChIKey

NLAWPKPYBMEWIR-SKYQDXIQSA-N

Smiles

COc1ccc(cc1)[C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc3O2