Homochelidonine

(4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol

Also Known As: Homochelidonine|alpha-Allocryptopine|alpha-Homochelidonine|?-Homochelidonine|Doxycycline hyclate|A-ALLOCRYPTOPINE|NORCHELIDONINE|(+/-)-Homochelidonine|(+)-HOMOCHELIDONINE|HOMOCHELIDONINE [MI]|.ALPHA.-HOMOCHELIDONINE|HOMOCHELIDONINE, (+)-|Homochelidonine (6CI,7CI,8CI)|KST-1A5765|NP0076|(4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol|(4br,5s,11bs)-1,2-dimethoxy-12-methyl-4b,5,6,11b,12,13-hexahydro[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol|(4BR-(4balpha,5beta,11balpha))-4b,5,6,11b,12,13-hexahydro-1,2-dimethoxy-12-methyl(1,3)benzodioxolo(5,6-c)phenanthridin-5-ol|(1,3)BENZODIOXOLO(5,6-C)PHENANTHRIDIN-5-OL, 4B,5,6,11B,12,13-HEXAHYDRO-1,2-DIMETHOXY-12-METHYL-, (4BR,5S,11BS)-|(1,3)BENZODIOXOLO(5,6-C)PHENANTHRIDIN-5-OL, 4B,5,6,11B,12,13-HEXAHYDRO-1,2-DIMETHOXY-12-METHYL-, (4BR-(4B.ALPHA.,5.BETA.,11B.ALPHA.))-|(1S,12S,13R)-17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-2,4(8),9,14,16,18-hexaen-12-ol|(4bR)-4b,5,6,11balpha,12,13-Hexahydro-1,2-dimethoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridin-5beta-ol|(4bR,5S,11bS)-1,2-Dimethoxy-12-methyl-4b,5,6,11b,12,13-hexahydro-9H-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol|(4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-(1,3)benzodioxolo(5,6-c)phenanthridin-5-ol|(4BR-(4B.ALPHA.,5.BETA.,11B.ALPHA.))-4B,5,6,11B,12,13-HEXAHYDRO-1,2-DIMETHOXY-12-METHYL(1,3)BENZODIOXOLO(5,6-C)PHENANTHRIDIN-5-OL

Molecular Formula	C21H23NO5
Molecular Weight	369.15762 g/mol
LogP	2.3
Topological Polar Surface Area	60.4 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	369.15762
Monoisotopic Mass	369.15762
Heavy Atoms	27
Complexity	547.0

Chemical Identifiers

CAS Number	5440-40-4
SMILES	CN1CC2=C(C=CC(=C2OC)OC)[C@@H]3[C@H]1C4=CC5=C(C=C4C[C@@H]3O)OCO5
InChIKey	MADYLZJCRKUBIK-RYGJVYDSSA-N