3-((6-Desoxy-3-O-methyl-D-galacto-pyranosyl)oxy)-14,16-dihydroxy-card-20(22)-enolid,(3 alpha, 5 beta, 16 beta)-
3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
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Grundinformationen
- CAS
595-21-1- Standard-SMILES
COC1C(O)[C@H](O[C@H]2CC[C@]3(C)C4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)C(O)C[C@]5(O)C4CC[C@@H]3C2)OC(C)[C@@H]1O- InChIKey
CPFNIKYEDJFRAT-RHZHZRSRSA-N- Summenformel
- C30H46O9
- Durchschnittliche Molmasse
- 550,689 g/mol
- Monoisotopische Masse
- 550,31418305
Namen und Bezeichner
- Bevorzugter Name
- 3-[(6-Deoxy-3-O-methylhexopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
- IUPAC
- (8xi,9xi,17R)-3beta-[(6-Deoxy-3-O-methyl-alpha-L-glycero-hexopyranosyl)oxy]-14,16alpha-dihydroxy-5beta-card-20(22)-enolide
- Lokaler Name
- 3-((6-Desoxy-3-O-methyl-D-galacto-pyranosyl)oxy)-14,16-dihydroxy-card-20(22)-enolid,(3 alpha, 5 beta, 16 beta)-
- Englischer Name
- (3beta,5beta,16beta)-3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
- Summenformel
- C30H46O9
- Molmasse
- 550.68
Namen und Synonyme
StropesidDigicosideStrospesideGitoxigenin 3-O-monodigitaloside3β-[(6-Deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16β-dihydroxy-5β-card-20(22)-enolideCard-20(22)-enolide, 3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxy-, (3β,5β,16β)-(3beta,5beta,16beta)-3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide3-[(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one3-[(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-3,5-dihydroxy-4-methoxy-6-methyl-oxan-2-yl]oxy-14,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one3-[(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-3,5-dihydroxy-4-methoxy-6-methyl-tetrahydropyran-2-yl]oxy-14,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Datenbank-Bezeichner
- CAS
595-21-1- PubChem CID
- 11680
- DTXSID
DTXSID90974903
Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 244.5 °C · 244.5°C
- Siedepunkt
- 542.03 °C · 542.03°C (rough estimate)
- Dichte
- 1.1165 · 1.1165 (rough estimate)
- Brechungsindex
- 1.55 · 1.5500 (estimate)
- pka
- 12.92 · 12.92±0.70(Predicted)
Chemie und Industrie
Anbieter4 Anbieter
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
四川精萃天成药物科技有限公司028-87865381 18108190480 · [email protected]
成都普瑞法科技开发有限公司+86-28-82633860; +86-18080483897 · [email protected]
Ergänzende Hinweise
DefinitionChEBI: A cardenolide glycoside in which the parent structure gitoxigenin is glycosylated at the 3beta-hydroxy group by beta-D-digitalose.
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