Drugs Information: Tacrolimus
Basic Information
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| ID | DDInter1735 | |
| Drug Type | small molecule | |
| Molecular Formula | C44H69No12 | |
| Molecular Weight | 804.031 | |
| Description | Tacrolimus is a calcineurin inhibitor used to prevent organ transplant rejection and to treat moderate to severe atopic dermatitis. | |
| ATC Classification | D11AH01 L04AD02 | |
| IUPAC Name | (1R,9S,12S,13R,14S,17R,18E,21S,23S,24R,25S,27R)-1,14-Dihydroxy-12-[(1E)-1-[(1R,3R,4R)-4-Hydroxy-3-Methoxycyclohexyl]Prop-1-En-2- | |
| InChI | Inchi=1S/C44H69No12/C1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-39(29(6)34(47)24-35(31)48)27(4)21-30-15-16-33(46)36(23-30)53-7/H10,19,21,26,28-34,36-40,46-47,52H,1,11-18,20,22-24H2,2-9H3/B25-19+,27-21+/T26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38-,39+,40+,44+/M0/S1 | |
| InChI Key | QJJXYPPXXYFBGM-LFZNUXCKSA-N | |
| Canonical SMILES | CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C(/C)[C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H]([C@H](C[C@H]2C)OC)[C@H](C[C@@H](C)C\C(C)=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]1C)OC | |
| Useful Links | DrugBank ChEMBL PubChem | |
Interactions with Tacrolimus
| Severity level | ID | Name | Mechanism | Detail |
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