| Compound | 6'-desmethylthalifaboramine |
| NPACT-Id | NPACT00186 |
| IUPAC | (8S)-11-[4-[[(1S)-6-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-1,2,13-trimethoxy-7-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-12-ol |
| Synonyms | - |
| PubChem Id | 10416673 |
| Class | Alkaloids |
| In-vitro anticancer activity | 5 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | RRRBUQLZAIRJQZ-VMPREFPWSA-N |
| InChi | 1S/C38H42N2O7/c1-39-13-11-22-16-30(41)31(43-3)19-25(22)28(39)15-21-7-9-24(10-8-21)47-37-27-18-29-34-23(12-14-40(29)2)17-33(45-5)38(46-6)35(34)26(27)20-32(44-4)36(37)42/h7-10,16-17,19-20,28-29,41-42H,11-15,18H2,1-6H3/t28-,29-/m0/s1 |
| SMILES | O(c1c2c3[C@@H](N(CCc3cc1OC)C)Cc1c2cc(OC)c(O)c1Oc1ccc(C[C@@H]2N(CCc3c2cc(OC)c(O)c3)C)cc1)C |
|
SMART | [#6]OC1=C(O)C=C2CC[N@@]([#6])[C@@H](CC3=CC=C(OC4=C5C[C@@H]6[N@]([#6])CCC7=CC(O[#6])=C(O[#6])C(C5=CC(O[#6])=C4O)=C67)C=C3)C2=C1 |
| CAS No. | - |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | NA, |
| Drug-Likeliness Filters | Lipinski's rule of five | No |
| Ghose filter | No |
| Veber filter | Yes |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |