Primary Record
CNI103
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 156464904
- SMILES
- CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC1=CNC=N1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCCOCCOCC(=O)N[C@@H](CCCCNC(=O)CC[C@H]2C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N2)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N)CC3=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5)C(=O)N)NC(=O)[C@H](C(C)(C)O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](C(C)(C)C)NC(=O)C6=C(C(=NC=C6)Cl)Cl
- Canonical SMILES
- CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)c1ccnc(Cl)c1Cl)C(C)(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCCOCCOCC(=O)N[C@@H](CCCCNC(=O)CC[C@@H]1NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(N)=O)[C@@H](C)O)[C@@H](C)CC)C(C)(C)O
Names & Synonyms
- CNI103
- CHEMBL4756979
- SCHEMBL23485620
- Calcineurin-NFAT blocker CNI103
- GLXC-23066
- (S)-N1-((2S,5R,8S,20S)-28-((2S,5R,8S,11S,14R,17S,20R)-5-benzyl-11,14,17,20-tetrakis(3-guanidinopropyl)-8-(naphthalen-2-ylmethyl)-3,6,9,12,15,18,21-heptaoxo-1,4,7,10,13,16,19-heptaazacyclohenicosan-2-yl)-20-carbamoyl-8-(hydroxymethyl)-1-(1H-imidazol-4-yl)-5-isobutyl-3,6,9,18,26-pentaoxo-13,16-dioxa-4,7,10,19,25-pentaazaoctacosan-2-yl)-2-((3S,6S,9S,12S,15S)-6,12-di((S)-sec-butyl)-3-(tert-butyl)-1-(2,3-dichloropyridin-4-yl)-15-((R)-1-hydroxyethyl)-9-(2-hydroxypropan-2-yl)-1,4,7,10,13-pentaoxo-2,5,8,11,14-pentaazahexadecan-16-amido)pentanediamide