Primary Record
J2.018.572D
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 177514455
- SMILES
- C[C@H]1C(=O)N2CCC[C@H]2C(=O)NC(CC(=O)NCC(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)NCC(=O)NC(C(=O)N1)[C@@H](C)O)CC3=CNC=N3)CC4=CNC5=CC=CC=C54)CC(=O)N)C(=O)N[C@@H](CC6=CNC7=CC=CC=C76)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N8CCC[C@H]8C(=O)N[C@H](CS)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCSC)C(=O)O
- Canonical SMILES
- CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C1CC(=O)NCC(=O)NC(CC(N)=O)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NC(Cc2c[nH]cn2)C(=O)NCC(=O)NC([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)N1)C(C)C)C(C)C)C(=O)O
Names & Synonyms
- J2.018.572D
- (2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-{2-[(2S)-2-[(2S)-2-[(2S)-2-{[(3S,10S,13S,16S,22S,25S,30aS)-10-(carbamoylmethyl)-22-[(1R)-1-hydroxyethyl]-16-[(1H-imidazol-4-yl)methyl]-13-[(1H-indol-3-yl)methyl]-25-methyl-1,5,8,11,14,17,20,23,26-nonaoxo-triacontahydropyrrolo[2,1-c]1,4,7,10,13,16,19,22,25-nonaazacyclooctacosan-3-yl]formamido}-3-(1H-indol-3-yl)propanamido]-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]acetamido}-4-methylpentanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-3-methylbutanamido]-3-methylbutanamido]-4-(methylsulfanyl)butanoic acid
- Cyclo[Gly-L-Asn-L-Trp-L-His-Gly-L-Thr-L-Ala-L-Pro-[(3S)-3-[[(1S,4S,7S,13S,16S,19S,22S,25S,28S)-28-carboxy-1-(1H-indole-3-ylmethyl)-13-isobutyl-22,25-diisopropyl-4-(hydroxymethyl)-19-(mercaptomethyl)-7-[2-(methylthio)ethyl]-30-(methylthio)-2,5,8,11,14,17,20,23,26-nonaoxo-15,16-propano-3,6,9,12,15,18,21,24,27-nonaazatriacontane-1-yl]carbamoyl]-betaAla-]]
- Cyclo[Gly-L-Asn-L-Trp-L-His-Gly-L-Thr-L-Ala-L-Pro-L-betaalphaAsp-(L-Trp-L-Ser-L-Met-Gly-L-Leu-L-Pro-L-Cys-L-Val-L-Val-L-Met-OH)-]