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Substance Name: Oxyline
RN: 132741-68-5
InChIKey: MQKNLRFUHOJEGN-UHFFFAOYSA-N

Note

  • Isolated from Oxystelma esculentum; a cardenolide tetraglycoside.

Molecular Weight

  • 953.165
 
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Names and Synonyms

Name of Substance

  • Oxyline

Synonym

  • 3-Uzarigenin-3-O-beta-cymaropyranosyl-(1-4)-O-beta-thevetopyranosyl-(1-4)-O-beta-cymaropyranosyl-(1-4)-O-beta digitoxopyranoside

Systematic Name

  • Card-20(22)-enolide, 3-((O-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1-4)-O-6-deoxy-3-O-methyl-beta-D-glucopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl))

Registry Numbers

CAS Registry Number

  • 132741-68-5

System Generated Number

  • 0132741685

Structure Descriptors

InChI

InChI=1S/C50H80O17/c1-24-41(53)35(56-7)21-39(60-24)66-45-27(4)63-47(42(54)46(45)58-9)67-44-26(3)62-40(22-36(44)57-8)65-43-25(2)61-38(20-34(43)51)64-30-12-15-48(5)29(19-30)10-11-33-32(48)13-16-49(6)31(14-17-50(33,49)55)28-18-37(52)59-23-28/h18,24-27,29-36,38-47,51,53-55H,10-17,19-23H2,1-9H3

InChIKey

MQKNLRFUHOJEGN-UHFFFAOYSA-N

Smiles

COC1CC(OC2C(C)OC(OC3C(C)OC(CC3OC)OC4C(O)CC(OC5CCC6(C)C(CCC7C6CCC8(C)C(CCC78O)C9=CC(=O)OC9)C5)OC4C)C(O)C2OC)OC(C)C1O