Primary Record
CHEMBL1086463
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 46890553
- SMILES
- C[C@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCSC)NC(=O)CCCCN2C=C(N=N2)CCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)OP(=O)(O)O
- Canonical SMILES
- CSCC[C@H](NC(=O)CCCCn1cc(CCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)nn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)OP(=O)(O)O
Names & Synonyms
- CHEMBL1086463
- BDBM50319375
- (2R,3S,6S,9S,12S)-9-(3-amino-3-oxopropyl)-18-(4-(4-((S)-1-((S)-1-((S)-2-((S)-1-((S)-1-((S)-1-carboxy-3-methylbutylamino)-4-methyl-1-oxopentan-2-ylamino)-3-(4-hydroxyphenyl)-1-oxopropan-2-ylcarbamoyl)pyrrolidin-1-yl)-5-guanidino-1-oxopentan-2-ylamino)-5-guanidino-1-oxopentan-2-ylamino)-4-oxobutyl)-1H-1,2,3-triazol-1-yl)-3-((S)-2-((S)-1-carboxy-3-methylbutylcarbamoyl)pyrrolidine-1-carbonyl)-6-(hydroxymethyl)-12-(2-(methylthio)ethyl)-5,8,11,14-tetraoxo-4,7,10,13-tetraazaoctadecan-2-yl phosphate