| IDENTIFIER |
|---|
| IDNUMBER | NAME | CAS | MDL |
|---|
| ST059290 | Lagochiline | | MFCD06245022 |
| IUPACNAME |
|---|
| (6S,2R)-2,12-bis(hydroxymethyl)-12-(2-hydroxyethyl)-2,6,8-trimethylspiro[bicyc lo[4.4.0]decane-7,5'-oxolane]-3-ol |
| Smiles |
|---|
| C1C([C@@](C2[C](C1)(C1(C(CC2)C)CCC(O1)(CO)CCO)C)(C)CO)O |
| TRADEMARK |
|---|
| | INCHI |
|---|
| InChI=1S/C20H36O5/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21/h14-16,21-24H,4-13H2,1-3H3/t14?,15?,16?,17-,18-,19?,20?/m0/s1 |
| INCHIKEY |
|---|
| InChIKey=XYPPDQHBNJURHU-KBXWKRFBSA-N |
| Chem-Physical |
|---|
| Formula | Molecular Weight | SALT | Absorption |
|---|
| C20H36O5 | 356.5 | | 0.62 |
| LogP | LogS | Lipinsky | Acceptors |
|---|
|
| 2.59 | -4.22 | 4 | 5 |
| Donors | Rotation Bonds | Chiral Centers | N+O |
|---|
| 4 | 8 | 7 | 5 |
| ACTIVITY |
|---|
| THERAPEUTIC CATEGORY | VET THERAPEUTIC CATEGORY |
|---|
| |
| Sedative, hemostatic, hypotensitive effects |
| REFERENCE |
|---|
| Pulatova TP., Khazanovich RL. On the alkaloid content of some Lagochilus species and on the nature of lagochiline. Aptechn Delo. 1962 Nov-Dec;6:29-32 Schultes RE. Science. 163:245-54 (1969) |
