Leurosine

methyl (13S,15S,16R,18S)-13-[(1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-10-hydroxy-5-methoxy-10-methoxycarbonyl-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraen-4-yl]-18-ethyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraene-13-carboxylate

Also Known As: Vinleurosine|LEUROSINE|Vinleurosina|Vinleurosinum|Amotin|Amotin [Russian]|Vinleurosine [INN]|Vinblastine Impurity F|LEUROSINE SULFATE|VINLEUROSINE SULFATE|Vinleurosinum [INN-Latin]|Vinleurosina [INN-Spanish]|Vinorelbine EP Impurity E|VINLEUROSINE [HSDB]|LEUROSINE [EP IMPURITY]|Vincristine Sulfate EP Impurity F|TN2301|NCI60_042012|4-27-00-09622 (Beilstein Handbook Reference)|3'beta,12beta-O~3'~,3'-Cyclovincaleukoblastine|(3'R,4'S)-3',4'-Oxy-4'-deoxyvincaleukoblastine|Vincaleukoblastine, 4'-deoxy-3',4'-epoxy-, (3'alpha,4'alpha)-|VINCRISTINE SULFATE IMPURITY F [EP IMPURITY]|VINORELBINE TARTRATE IMPURITY E [EP IMPURITY]|4-DEOXY-3.ALPHA.,4.ALPHA.-EPOXYVINCALEUKOBLASTINE|N0001-010522|Vincaleukoblastine, 4'-deoxy-3',4'-epoxy-, (3'-alpha,4'-alpha)-|Vinorelbine EP Impurity E; Vincristine EP Impurity F; Leurosine

Molecular Formula	C46H56N4O9
Molecular Weight	808.4047 g/mol
LogP	3.7
Topological Polar Surface Area	146.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	12
Rotatable Bonds	10
Exact Mass	808.4047
Monoisotopic Mass	808.4047
Heavy Atoms	59
Complexity	1750.0

Chemical Identifiers

CAS Number	23360-92-1
SMILES	CC[C@]12CN3CCC4=C([C@](C[C@@H](C3)[C@H]1O2)(C5=C(C=C6C(=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)NC1=CC=CC=C41
InChIKey	LPGWZGMPDKDHEP-NVDFJPPOSA-N