Primary Record
SCHEMBL29411880
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 132528314
- SMILES
- C[C@H]1C(=O)N[C@H](C(=O)N2CCC[C@@H]2C(=O)N3CCC[C@H]3C(=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)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCN)CCCN)CC4=CNC5=CC=CC=C54)CCCN=C(N)N)CCCCN)CCCN)CCN)CC(C)C)CC6=CNC7=CC=CC=C76)[C@@H](C)O)CCCCN
- Canonical SMILES
- CC(C)C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCN)NC(=O)[C@H](CCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN)NC(=O)[C@H](CCN)NC1=O
Names & Synonyms
- SCHEMBL29411880
- LB-01
- J3.579.510C
- Cyclo(L-Thr-L-Trp-L-Leu-L-A2bu-L-Orn-L-Lys-L-Arg-L-Trp-L-Orn-L-A2bu-L-Ala-L-Lys-D-Pro-L-Pro-)
- N-{3-[(3R,9S,12S,15S,18S,21S,24S,27S,30S,33S,36S,39S,42S,45S)-9,27-bis(4-aminobutyl)-15,33-bis(2-aminoethyl)-18,30-bis(3-aminopropyl)-42-[(1R)-1-hydroxyethyl]-21,39-bis[(1H-indol-3-yl)methyl]-12-methyl-36-(2-methylpropyl)-2,8,11,14,17,20,23,26,29,32,35,38,41,44-tetradecaoxo-1,7,10,13,16,19,22,25,28,31,34,37,40,43-tetradecaazatricyclo[43.3.0.03,7]octatetracontan-24-yl]propyl}guanidine