PDB CCD ID: | JDC | ||||||||||||
Number of entries in BioLiP: | 4 | ||||||||||||
Chemical formula: | C28 H39 N3 O3 | ||||||||||||
InChI: | InChI=1S/C28H39N3O3/c1-18(2)26(30-27(34)25-13-20-8-9-24(33)12-21(20)15-29-25)17-31-11-10-28(4,19(3)16-31)22-6-5-7-23(32)14-22/h5-9,12,14,18-19,25-26,29,32-33H,10-11,13,15-17H2,1-4H3,(H,30,34)/t19-,25+,26+,28+/m0/s1 | ||||||||||||
InChIKey: | ZLVXBBHTMQJRSX-VMGNSXQWSA-N | ||||||||||||
SMILES: |
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Name: | (3R)-7-hydroxy-N-{(2S)-1-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]-3-methylbutan-2-yl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide | ||||||||||||
ChEMBL: | CHEMBL415247 | ||||||||||||
ZINC: | ZINC000003940643 |