Drug ID: | NPD8345 |
Drug Name: | |
Molecular Formula: | C42H78N2O14 |
Canonical SMILES: | COCCOCC1NC2C(C)CC(C)(O)C(OC3OC(C)CC(C3O)N(C)C)C(C)C(C(C(=O)OC(C(C(O1)C2C)(C)O)CC)C)OC1OC(C)C(C(C1)(C)OC)O |
Standard InCHI: | InChI=1S/C42H78N2O14/c1-15-29-42(10,49)37-24(4)32(43-30(56-37)21-52-17-16-50-13)22(2)19-40(8,48)36(58-39-33(45)28(44(11)12)18-23(3)53-39)25(5)34(26(6)38(47)55-29)57-31-20-41(9,51-14)35(46)27(7)54-31/h22-37,39,43,45-46,48-49H,15-21H2,1-14H3 |
Standard InCHIKey: | WLOHNSSYAXHWNR-UHFFFAOYSA-N |
Max Developmental Stage: | Approved |
Max Developmental Stage Source: | TTD |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7