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Substance Name: Arctignan E
RN: 155661-12-4
UNII: 98Y1GGN1XX
InChIKey: BQAUNBCJFDCZFB-FGEPHIOBSA-N

Molecular Formula

  • C40-H44-O13

Molecular Weight

  • 732.7746
 
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Names and Synonyms

Name of Substance

  • Arctignan E

Synonyms

  • 2(3H)-Furanone, 4-(((2S,3R)-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-5-benzofuranyl)methyl)dihydro-3-((4-hydroxy-3-(2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethyl)-5-methoxyphenyl)methyl)-, (3S,4R)-
  • Arctignan E
  • UNII-98Y1GGN1XX

Registry Numbers

CAS Registry Number

  • 155661-12-4

FDA UNII

  • 98Y1GGN1XX

System Generated Number

  • 0155661124

Structure Descriptors

InChI

1S/C40H44O13/c1-48-32-15-22(5-7-30(32)43)36(45)28(17-41)26-11-21(13-34(50-3)37(26)46)10-25-24(19-52-40(25)47)9-20-12-27-29(18-42)38(53-39(27)35(14-20)51-4)23-6-8-31(44)33(16-23)49-2/h5-8,11-16,24-25,28-29,36,38,41-46H,9-10,17-19H2,1-4H3/t24-,25+,28?,29-,36?,38+/m0/s1

InChIKey

BQAUNBCJFDCZFB-FGEPHIOBSA-N

Smiles

COc1cc(ccc1O)[C@@H]2[C@H](c3cc(cc(c3O2)OC)C[C@H]4COC(=O)[C@@H]4Cc5cc(c(c(c5)OC)O)C(CO)C(c6ccc(c(c6)OC)O)O)CO