PDB CCD ID: | 01E | ||||||||||||
Number of entries in BioLiP: | 4 | ||||||||||||
Chemical formula: | C31 H44 I N5 O6 | ||||||||||||
InChI: | InChI=1S/C31H44IN5O6/c1-19(25(40)28(42)33-18-20-10-12-21(32)13-11-20)34-27(41)22(16-24(39)37-14-8-9-15-37)35-29(43)26(31(5,6)7)36-23(38)17-30(2,3)4/h8-15,19,22,25-26,40H,16-18H2,1-7H3,(H,33,42)(H,34,41)(H,35,43)(H,36,38)/t19-,22-,25-,26+/m0/s1 | ||||||||||||
InChIKey: | DUBMDYQWHSIBPD-FBESYSLLSA-N | ||||||||||||
SMILES: |
| ||||||||||||
Name: | (2S)-2-(3,3-dimethylbutanoylamino)-N-[(2S)-1-[[(2S,3S)-3-hydroxy-4-[(4-iodophenyl)methylamino]-4-oxo-butan-2-yl]amino]- 1,4-dioxo-4-pyrrol-1-yl-butan-2-yl]-3,3-dimethyl-butanamide; BILC 821 | ||||||||||||
ZINC: | ZINC000098207734 |