PDB CCD ID: | 2K2 | ||||||||||||
Number of entries in BioLiP: | 4 | ||||||||||||
Chemical formula: | C35 H30 N4 O4 | ||||||||||||
InChI: | InChI=1S/C35H30N4O4/c1-35-32(42-3)25(37(2)34(41)19-11-5-4-6-12-19)17-26(43-35)38-23-15-9-7-13-20(23)28-29-22(18-36-33(29)40)27-21-14-8-10-16-24(21)39(35)31(27)30(28)38/h4-16,25-26,32H,17-18H2,1-3H3,(H,36,40)/t25-,26-,32-,35+/m1/s1 | ||||||||||||
InChIKey: | BMGQWWVMWDBQGC-IIFHNQTCSA-N | ||||||||||||
SMILES: |
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Name: | PKC412; N-[(5S,6R,7R,9R)-6-methoxy-5-methyl-14-oxo-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonon a[1,2,3,4-jkl]cyclopenta[e]-as-indacen-7-yl]-N-methylbenzamide | ||||||||||||
ChEMBL: | CHEMBL608533 | ||||||||||||
DrugBank: | DB06595 | ||||||||||||
ZINC: | ZINC000100013130 |

Reference: