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Substance Name: Angoroside C
RN: 115909-22-3
UNII: 8G0I99W72T
InChIKey: KLQXMRBGMLHBBQ-DQTDZZOCSA-N

Note

  • Angoroside C is the (E)-isomer.

Molecular Weight

  • 784.7562
 
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Names and Synonyms

Name of Substance

  • Angoroside C

Synonym

  • UNII-8G0I99W72T

Registry Numbers

CAS Registry Number

  • 115909-22-3

FDA UNII

  • 8G0I99W72T

System Generated Number

  • 0115909223

Structure Descriptors

InChI

1S/C36H48O19/c1-16-26(41)28(43)30(45)36(52-16)55-33-31(46)35(49-11-10-18-5-8-22(47-2)20(38)12-18)53-24(15-51-34-29(44)27(42)21(39)14-50-34)32(33)54-25(40)9-6-17-4-7-19(37)23(13-17)48-3/h4-9,12-13,16,21,24,26-39,41-46H,10-11,14-15H2,1-3H3/b9-6+/t16-,21-,24+,26-,27-,28+,29+,30+,31+,32+,33+,34-,35+,36-/m0/s1

InChIKey

KLQXMRBGMLHBBQ-DQTDZZOCSA-N

Smiles

COc1ccc(CCO[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@@H](OC(=O)\C=C\c4ccc(O)c(OC)c4)[C@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@H]2O)cc1O