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CHEBI:747917 - tacrolimus anhydrous
| Formula | C44H69NO12 |
| Net Charge | 0 |
| Average Mass | 804.031 |
| Monoisotopic Mass | 803.48198 |
| SMILES | [H][C@@]12O[C@@](O)(C(=O)C(=O)N3CCCC[C@@]3([H])C(=O)O[C@H](/C(C)=C/[C@@H]3CC[C@@H](O)[C@H](OC)C3)[C@H](C)[C@@H](O)CC(=O)[C@H](CC=C)/C=C(\C)C[C@H](C)C[C@@H]1OC)[C@H](C)C[C@@H]2OC |
| 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 |
| InChIKey | QJJXYPPXXYFBGM-LFZNUXCKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| tacrolimus anhydrous (CHEBI:747917) has role anti-anaemic agent (CHEBI:75835) |
| tacrolimus anhydrous (CHEBI:747917) has role anti-asthmatic agent (CHEBI:65023) |
| tacrolimus anhydrous (CHEBI:747917) has role anti-inflammatory agent (CHEBI:67079) |
| tacrolimus anhydrous (CHEBI:747917) has role antifibrotic agent (CHEBI:233423) |
| tacrolimus anhydrous (CHEBI:747917) has role antifungal agent (CHEBI:35718) |
| tacrolimus anhydrous (CHEBI:747917) has role antihypertensive agent (CHEBI:35674) |
| tacrolimus anhydrous (CHEBI:747917) has role antiinfective agent (CHEBI:35441) |
| tacrolimus anhydrous (CHEBI:747917) has role antineoplastic agent (CHEBI:35610) |
| tacrolimus anhydrous (CHEBI:747917) has role antipsoriatic (CHEBI:50748) |
| tacrolimus anhydrous (CHEBI:747917) has role antirheumatic drug (CHEBI:35842) |
| tacrolimus anhydrous (CHEBI:747917) has role antiviral agent (CHEBI:22587) |
| tacrolimus anhydrous (CHEBI:747917) has role cardiovascular drug (CHEBI:35554) |
| tacrolimus anhydrous (CHEBI:747917) has role dermatologic drug (CHEBI:50177) |
| tacrolimus anhydrous (CHEBI:747917) has role hypoglycemic agent (CHEBI:35526) |
| tacrolimus anhydrous (CHEBI:747917) has role immunosuppressive agent (CHEBI:35705) |
| tacrolimus anhydrous (CHEBI:747917) has role nephroprotective agent (CHEBI:76595) |
| tacrolimus anhydrous (CHEBI:747917) has role ophthalmology drug (CHEBI:66981) |
| tacrolimus anhydrous (CHEBI:747917) has role renoprotective agent (CHEBI:231911) |
| tacrolimus anhydrous (CHEBI:747917) has role vulnerary (CHEBI:73336) |
| tacrolimus anhydrous (CHEBI:747917) is a organic molecular entity (CHEBI:50860) |
| tacrolimus anhydrous (CHEBI:747917) is a peptide (CHEBI:16670) |
| Synonyms | Source |
|---|---|
| 104987-11-3 | ChEMBL |
| Prograph | ChEMBL |
| Tacro | ChEMBL |
| Tacrolimus, anhydrous | ChEMBL |
| Citations |
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