CAS Registry Number®
20830-75-5
CAS Name
Digoxin
Molecular Formula
C41H64O14
Molecular Mass
780.94
Compound Properties
-
Melting Point (1)
~235 °C (decomp) (approx)
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3
InChIKey
InChIKey=LTMHDMANZUZIPE-UHFFFAOYSA-N
SMILES
OC12C(C)(C(CC1)C3=CC(=O)OC3)C(O)CC4C2CCC5C4(C)CCC(OC6CC(O)C(OC7CC(O)C(OC8CC(O)C(O)C(C)O8)C(C)O7)C(C)O6)C5
Canonical SMILES
O=C1OCC(=C1)C2CCC3(O)C4CCC5CC(OC6OC(C)C(OC7OC(C)C(OC8OC(C)C(O)C(O)C8)C(O)C7)C(O)C6)CCC5(C)C4CC(O)C23C
Other Names for this Substance
- Card-20(22)-enolide, 3-[(O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D–ribo-hexopyranosyl)oxy]-12,14-dihydroxy-, (3β,5β,12β)-
- Digoxin
- Digitoxin, 12β-hydroxy-
- (3β,5β,12β)-3-[(O-2,6-Dideoxy-β-D-ribo-hexopyranosyl-(1→4)-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-β-D–ribo-hexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-enolide
- Lanoxin
- Rougoxin
- Chloroformic digitalin
- Homolle’s digitalin
- Homolle digitalin
- Digacin
- Lanicor
- Digosin
- 12β-Hydroxydigitoxin
- Cordioxil
- Davoxin
- Dixina
- Lanocardin
- Dilanacin
- Digoxin Nativelle
- Lanoxicaps
- Cardiogoxin
- Cardigox
- Coragoxine
- Digicor
- Digomal
- Digon
- Digoxine
- Cardioxin
- Cardoxin
- Grexin
- Lanacordin
- Lanacrist
- Lanikor
- Lanorale
- Lanoxin PG
- Lenoxicaps
- Lenoxin
- Mapluxin
- Natigoxin
- Novodigal-Amp.
- Purgoxin
- Toloxin
- Eudigox
- Fargoxin
- Dynamos
- Longdigox
- Dokim
- Stillacor
- Vanoxin
- NeoDioxanin
- NSC 95100
- Cardixin
- Digitek
- MeSH ID: D004077
Deleted or Replaced CAS Registry Numbers
36-35-1, 8001-36-3, 8001-37-4, 8001-52-3, 11000-95-6, 39366-41-1, 82476-60-6
