9-{[3-(Dimethylamino)propyl]amino}-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydro-2H-furo[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one

4'-O-demethyl-4-((3''-(dimethylamino)propyl)amino)-4-desoxypodophyllotoxin · Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 9-[[3-(dimethylamino)propyl]amino]-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R,5aR,8aS,9S)-

https://huagongshe.com/de/chemical/160366

Molekülstruktur von 9-{[3-(Dimethylamino)propyl]amino}-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydro-2H-furo[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one

Identifikatoren & physikalische Daten

CAS No.	152833-16-4
Summenformel	C26H32N2O7
Durchschnittliche Molmasse	484,549 g/mol
Monoisotopische Masse	484,22095136 g/mol
SMILES	COc1cc([C@@H]2c3cc4c(cc3[C@@H](NCCCN(C)C)[C@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1O
InChIKey	YPFPNLDTVOTTIA-QQJYNPJZSA-N
PubChem CID	160366
ChEMBL	CHEMBL28538
DTXSID	DTXSID40934613

Chemische & physikalische Eigenschaften

Siedepunkt	652.644±55.00 °C(Press: 760.00 Torr)(predicted)
Dichte	1.347±0.10 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted)
pKa (Säurekonstante)	9.940±0.40(predicted)