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Substance Name: Neocomplanoside
RN: 123442-25-1
InChIKey: DDGCBCUITQFEFG-ZTHZTRLZSA-N

Note

  • Isolated from Astragalus complanatus.

Molecular Weight

  • 504.4416
 
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Names and Synonyms

Name of Substance

  • Neocomplanoside

Systematic Name

  • 4H-1-Benzopyran-4-one, 3-((6-O-acetyl-beta-D-glucopyranosyl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-

Registry Numbers

CAS Registry Number

  • 123442-25-1

System Generated Number

  • 0123442251

Structure Descriptors

InChI

1S/C24H24O12/c1-10(25)33-9-16-18(28)20(30)21(31)24(35-16)36-23-19(29)17-14(27)7-13(32-2)8-15(17)34-22(23)11-3-5-12(26)6-4-11/h3-8,16,18,20-21,24,26-28,30-31H,9H2,1-2H3/t16-,18-,20+,21-,24+/m1/s1

InChIKey

DDGCBCUITQFEFG-ZTHZTRLZSA-N

Smiles

COc1cc(O)c2C(=O)C(=C(Oc2c1)c3ccc(O)cc3)O[C@@H]4O[C@H](COC(=O)C)[C@@H](O)[C@H](O)[C@H]4O