Lythrine
(1S,13Z,17S,19S)-9-hydroxy-4,5-dimethoxy-16-oxa-24-azapentacyclo[15.7.1.18,12.02,7.019,24]hexacosa-2,4,6,8,10,12(26),13-heptaen-15-one
Also Known As: Lythrine|Cryogenine|(+)-Lythrine|LYTHRINE, (+)-|Cid 6441299|Lythran-12-one, 2'-hydroxy-4'',5''-dimethoxy-|(1S,13Z,17S,19S)-9-hydroxy-4,5-dimethoxy-16-oxa-24-azapentacyclo[15.7.1.18,12.02,7.019,24]hexacosa-2,4,6,8,10,12(26),13-heptaen-15-one|2 -Hydroxy-4 ,5 -dimethoxylythran-12-one|(1S,13Z,17S,19S)-9-hydroxy-4,5-dimethoxy-16-oxa-24-azapentacyclo(15.7.1.18,12.02,7.019,24)hexacosa-2,4,6,8,10,12(26),13-heptaen-15-one|(1S,17S,19S)-9-hydroxy-4,5-dimethoxy-16-oxa-24-azapentacyclo[15.7.1.18,12.02,7.019,24]hexacosa-2(7),3,5,8(26),9,11,13-heptaen-15-one|(4AS,6S,9Z,20S)-2,3,4,4A,5,6-HEXAHYDRO-14-HYDROXY-17,18-DIMETHOXY-20H-6,20-METHANO-11,15-METHENO-1H,8H-BENZO(G)PYRIDO(2,1-D)(1,5)OXAAZACYCLOHEXADECIN-8-ONE|20H-6,20-METHANO-11,15-METHENO-1H,8H-BENZO(G)PYRIDO(2,1-D)(1,5)OXAAZACYCLOHEXADECIN-8-ONE, 2,3,4,4A,5,6-HEXAHYDRO-14-HYDROXY-17,18-DIMETHOXY-, (4AS,6S,9Z,20S)-|N/A
| Molecular Formula | C26H29NO5 |
|---|---|
| Molecular Weight | 435.20456 g/mol |
| LogP | 4.7044 |
| Topological Polar Surface Area | 68.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 435.20456 |
| Monoisotopic Mass | 435.20456 |
| Heavy Atoms | 32 |
| Complexity | 1062.423 |
Chemical Identifiers
| CAS Number | 5286-10-2 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)[C@@H]3C[C@H](C[C@H]4N3CCCC4)OC(=O)/C=C\C5=CC2=C(C=C5)O)OC |
Product Overview
Lythrine (CAS 5286-10-2), with molecular formula C26H29NO5 and molecular weight 435.20456 g/mol. IUPAC: (1S,13Z,17S,19S)-9-hydroxy-4,5-dimethoxy-16-oxa-24-azapentacyclo[15.7.1.18,12.02,7.019,24]hexacosa-2,4,6,8,10,12(26),13-heptaen-15-one.