Galantamine, (+)-

HCID 906210CAS 60384-53-4

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Grundinformationen

Standard-SMILES: COc1ccc2c3c1O[C@@H]1C[C@H](O)C=C[C@]31CCN(C)C2
InChIKey: ASUTZQLVASHGKV-SUYBPPKGSA-N
Summenformel: C17H21NO3
Durchschnittliche Molmasse: 287,35 g/mol

Namen und Bezeichner

Bevorzugter Name: Galantamine, (+)-
IUPAC: (1R,12R,14S)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol
Englischer Name: Ent- galanthamine
Summenformel: C17H21NO3
Molmasse: 287.35

Namen und Synonyme

ent-Galanthamine(+)-GalanthamineGalantamine, (+)-Galanthamine, (+)-8L3T05AQ82UNII-8L3T05AQ82GALANTAMINE HYDROBROMIDE IMPURITY F [EP IMPURITY]GALANTHAMINE, (3.ALPHA.,4A.BETA.,12A.BETA.)-6H-BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL, 4A,5,9,10,11,12-HEXAHYDRO-3-METHOXY-11-METHYL-, (4AR,6S,8AR)-6H-BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL, 4A,5,9,10,11,12-HEXAHYDRO-3-METHOXY-11-METHYL-, (4AR-(4A.ALPHA.,6.BETA.,8AR*))-GALANTAMINE HYDROBROMIDE IMPURITY F (EP IMPURITY)RefChem:201028

Weitere Namen anzeigen

Epigalanthamin(+)-Galanthamine HBrGalantamine hydrobromide EP Impurity FEnt-GalantaMine (GalantaMine IMpurity F)Galantamine EP Impurity F (ent-Galantamine)Galantamine Impurity 6（Galantamine EP Impurity F）1-[(2-fluorophenyl)methyl]-4-methylsulfonylpiperazine

GALANTHAMINE, (3ALPHA,4ABETA,12ABETA)-6H-BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL, 4A,5,9,10,11,12-HEXAHYDRO-3-METHOXY-11-METHYL-, (4AR-(4AALPHA,6BETA,8AR*))-60384-53-4ENT- GALANTHAMINE(1R,12R,14S)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-olEnt-Galantamine(4aR,6S,8aR)-3-methoxy-11-methyl-5,6,9,10,11,12-hexahydro-4aH-benzo[2,3]benzofuro[4,3-cd]azepin-6-olGalantamine EP Impurity F

Datenbank-Bezeichner

CAS: 60384-53-4
PubChem CID: 906210
ChEMBL: CHEMBL3546248
UNII: 8L3T05AQ82
Nikkaji: J1.010.241C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 41,9 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 1
Schwere Atome: 21
Formalladung: 0
Komplexität: 440

Physikochemische Eigenschaften

Schmelzpunkt: 123 · 123-1260C
Siedepunkt: 439.3 · 439.3±45.0 °C(Predicted)
Dichte: 1.28 · 1.28±0.1 g/cm3(Predicted)
storage temp.: -20 °C · -20°C Freezer
Löslichkeit: Chloroform (Slightly), Ethanol (Slightly), Methanol (Slightly)
Aggregatzustand: Solid
pka: 13.93 · 13.93±0.20(Predicted)
Farbe: Off-White to Beige
InChI: InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m1/s1
InChIKey: ASUTZQLVASHGKV-SUYBPPKGSA-N
SMILES: N1(C)CC2=CC=C(OC)C3O[C@@]4([H])[C@](C=C[C@@H](O)C4)(C2=3)CC1