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Substance Name: Digitoxigenin-alpha-D-rhamnoside
RN: 6046-53-3
InChIKey: WQMLFJWIKARBFW-ISVUHCLVSA-N

Molecular Weight

  • 520.659
 
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Names and Synonyms

  • Digitoxigenin-alpha-D-rhamnoside

Registry Numbers

CAS Registry Number

  • 6046-53-3

System Generated Number

  • 0006046533

Structure Descriptors

InChI

1S/C29H44O8/c1-15-23(31)24(32)25(33)26(36-15)37-18-6-9-27(2)17(13-18)4-5-21-20(27)7-10-28(3)19(8-11-29(21,28)34)16-12-22(30)35-14-16/h12,15,17-21,23-26,31-34H,4-11,13-14H2,1-3H3/t15-,17-,18+,19-,20+,21-,23-,24+,25+,26-,27+,28-,29?/m1/s1

InChIKey

WQMLFJWIKARBFW-ISVUHCLVSA-N

Smiles

C1[C@@H](C[C@H]2CC[C@H]3[C@@]4(CC[C@@H](C=5COC(=O)C5)[C@@]4(C)CC[C@H]3[C@@]2(C1)C)O)O[C@@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@H](O1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 615ug/kg (0.615mg/kg)   Journal of Medicinal and Pharmaceutical Chemistry. Vol. 5, Pg. 988, 1962.