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Substance Name: Glycine, N-(aminoacetyl)-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide
RN: 42716-86-9
InChIKey: XHKRUTRVYSJRGI-QYWLGFMRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H36-N-O6

Molecular Weight

  • 488.621
 
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Names and Synonyms

Synonym

  • Digitoxigenin-3-beta-N-glycylglycyl ester

Systematic Name

  • Glycine, N-(aminoacetyl)-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide

Registry Numbers

CAS Registry Number

  • 42716-86-9

System Generated Number

  • 0042716869

Structure Descriptors

InChI

1S/C27H40N2O6/c1-25-8-5-18(35-24(32)14-29-22(30)13-28)12-17(25)3-4-21-20(25)6-9-26(2)19(7-10-27(21,26)33)16-11-23(31)34-15-16/h11,17-21,33H,3-10,12-15,28H2,1-2H3,(H,29,30)/t17-,18+,19-,20+,21-,25+,26-,27+/m1/s1

InChIKey

XHKRUTRVYSJRGI-QYWLGFMRSA-N

Smiles

C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)OC(=O)CNC(=O)CN

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 1077ug/kg (1.077mg/kg)   Farmaco, Edizione Scientifica. Vol. 36, Pg. 971, 1981.