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Substance Name: Ecdysone 25-O-glucopyranoside
RN: 112172-82-4
InChIKey: YJBCWBWOULRKGL-DGSLDROASA-N

Note

  • Metabolite of ecdysone in Parascaris equorum.

Molecular Weight

  • 626.7786
 
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Names and Synonyms

  • Ecdysone 25-O-glucopyranoside

Registry Numbers

CAS Registry Number

  • 112172-82-4

System Generated Number

  • 0112172824

Structure Descriptors

InChI

InChI=1S/C33H54O11/c1-16(21(35)8-9-30(2,3)44-29-28(41)27(40)26(39)25(15-34)43-29)17-7-11-33(42)19-12-22(36)20-13-23(37)24(38)14-31(20,4)18(19)6-10-32(17,33)5/h12,16-18,20-21,23-29,34-35,37-42H,6-11,13-15H2,1-5H3/t16-,17+,18-,20-,21?,23-,24-,25+,26+,27-,28+,29-,31+,32+,33?/m0/s1

InChIKey

YJBCWBWOULRKGL-DGSLDROASA-N

Smiles

C[C@H](C(O)CCC(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]2CCC3(O)C4=CC(=O)[C@@H]5C[C@H](O)[C@@H](O)C[C@]5(C)[C@H]4CC[C@]23C