(2R,3R,4S,5R,6R)-2-(acetoxymethyl)-6-(3-((R)-(6-methoxyquinolin-4-yl)((1S,2S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)thioureido)tetrahydro-2H-pyran-3,4,5-triyl triacetate
Grundinformationen
- CAS
1421852-79-0- Standard-SMILES
C=C[C@H]1C[N@]2CC[C@H]1C[C@H]2[C@H](NC(=S)N[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)c1ccnc2ccc(OC)cc12- InChIKey
MSUIGQCAMSHQNO-GWOFQAFOSA-N- Summenformel
- C35H44N4O10S
- Durchschnittliche Molmasse
- 712,8 g/mol
Namen und Bezeichner
- Bevorzugter Name
- (2R,3R,4S,5R,6R)-2-(acetoxymethyl)-6-(3-((R)-(6-methoxyquinolin-4-yl)((1S,2S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)thioureido)tetrahydro-2H-pyran-3,4,5-triyl triacetate
- IUPAC
- [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methyl]carbamothioylamino]oxan-2-yl]methyl acetate
- Englischer Name
- N-[(8α,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-Thiourea
- Summenformel
- C35H44N4O10S
- Molmasse
- 712.82
Namen und Synonyme
1421852-79-0(2R,3R,4S,5R,6R)-2-(acetoxymethyl)-6-(3-((R)-(6-methoxyquinolin-4-yl)((1S,2S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)thioureido)tetrahydro-2H-pyran-3,4,5-triyl triacetateN-[(8alpha,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)thiourea[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[[(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methyl]carbamothioylamino]oxan-2-yl]methyl acetateMFCD31537203N-[(8alpha,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)-ThioureaCS-0093207(2R,3R,4S,5R,6R)-2-(acetoxymethyl)-6-(3-((R)-(6-methoxyquinolin-4-yl)((1S,2S,4S,5R)-5-vinylquinuclidin-2-yl)methyl)thioureido)tetrahydro-2H-pyran-3,4,5-triyltriacetate9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)thiourea, 98%N-[(8,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl--D-glucopyranosyl)thioureaN-[(8?,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-o-acetyl-?-D-glucopyranosyl)thiourea, 98%N-[(8|A,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-|A-D-glucopyranosyl)thiourea
Weitere Namen anzeigen
9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)thiourea, 98%N-[(8α,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)thioureaN-[(8α,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-ThioureaN-[(8Α,9R)-6'-METHOXYCINCHONAN-9-YL]-N'-(2,3,4,6-TETRA-O-ACETYL-Β-D-GLUCOPYRANOSYL)- THIOUREAThiourea, N-[(8α,9R)-6'-methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-N-[(8α,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)thiourea,99%d.e.
N-[(8alpha,9R)-6'-Methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)thiourea,99%d.e.Thiourea, N-[(8|A,9R)-6'-methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-|A-D-glucopyranosyl)-Thiourea, N-[(8alpha,9R)-6'-methoxycinchonan-9-yl]-N'-(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)-
Datenbank-Bezeichner
- CAS
1421852-79-0
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,9
- Polarare Oberfläche (TPSA)
- 196 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 13
- Frei drehbare Bindungen
- 15
- Schwere Atome
- 50
- Formalladung
- 0
- Komplexität
- 1.270
Physikochemische Eigenschaften
- Siedepunkt
- 762 · 762.0±70.0 °C(Predicted)
- Dichte
- 1.34 · 1.34±0.1 g/cm3(Predicted)
- pka
- 10.63 · 10.63±0.70(Predicted)
Chemie und Industrie
Anbieter9 Anbieter
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