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CHEBI:135888 - pimecrolimus

Default Structure
ChEBI IDCHEBI:135888
ChEBI Namepimecrolimus
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC43H68ClNO11
Net Charge0
Average Mass810.466
Monoisotopic Mass809.44809
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](Cl)[C@H](OC)C3)[C@H](C)[C@@H](O)CC(=O)[C@H](CC)/C=C(\C)C[C@H](C)C[C@@H]1OC)[C@H](C)C[C@@H]2OC
InChIInChI=1S/C43H68ClNO11/c1-10-30-18-24(2)17-25(3)19-36(53-8)39-37(54-9)21-27(5)43(51,56-39)40(48)41(49)45-16-12-11-13-32(45)42(50)55-38(28(6)33(46)23-34(30)47)26(4)20-29-14-15-31(44)35(22-29)52-7/h18,20,25,27-33,35-39,46,51H,10-17,19,21-23H2,1-9H3/b24-18+,26-20+/t25-,27+,28+,29-,30+,31-,32-,33-,35+,36-,37-,38+,39+,43+/m0/s1
InChIKeyKASDHRXLYQOAKZ-XDSKOBMDSA-N
Roles Classification
Applications:
dermatologic drug  A drug used to treat or prevent skin disorders or for the routine care of skin.
ophthalmology drug  Any compound used for the treatment of eye conditions or eye diseases.
ChEBI Ontology
Outgoing Relation(s)
pimecrolimus (CHEBI:135888) has role dermatologic drug (CHEBI:50177)
pimecrolimus (CHEBI:135888) has role ophthalmology drug (CHEBI:66981)
pimecrolimus (CHEBI:135888) is a lactam (CHEBI:24995)
pimecrolimus (CHEBI:135888) is a macrolide (CHEBI:25106)
Synonyms  Source
elidelDrugCentral
picrolimusDrugCentral
(-)-pimecrolimusChEMBL
PimecrolimusChEMBL
SDZ ASM 981ChEMBL
SDZ ASM-981ChEMBL
Manual XrefsDatabases
2168DrugCentral
Registry NumbersSources
CAS:137071-32-0DrugCentral
Citations