Chemical Compound

DOAKLVKFURWEDJ-RWDRXURGSA-N

CAS Registry Number 103060-53-3
DOAKLVKFURWEDJ-RWDRXURGSA-N chemical structure
Primary Record

DOAKLVKFURWEDJ-RWDRXURGSA-N

In stock
1,477 g
Purity
98.1 %
CAS
103060-53-3

Compound Identifiers & Properties

CAS
103060-53-3
PubChem CID
170851048
SMILES
CCCCCCCCCC(=N[C@@H](CC1=CNC2=CC=CC=C21)C(=N[C@@H](CC(=N)O)C(=N[C@@H](CC(=O)O)C(=N[C@H]3[C@H](OC(=O)[C@@H](N=C([C@@H](N=C([C@H](N=C(CN=C([C@@H](N=C([C@H](N=C([C@@H](N=C([C@@H](N=C(CN=C3O)O)CCCN)O)CC(=O)O)O)C)O)CC(=O)O)O)O)CO)O)[C@H](C)CC(=O)O)O)CC(=O)C4=CC=CC=C4N)C)O)O)O)O
Canonical SMILES
CCCCCCCCCC(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CC(=N)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H]1C(O)=NCC(O)=N[C@@H](CCCN)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C)C(O)=N[C@@H](CC(=O)O)C(O)=NCC(O)=N[C@H](CO)C(O)=N[C@@H]([C@H](C)CC(=O)O)C(O)=N[C@@H](CC(=O)c2ccccc2N)C(=O)O[C@@H]1C

Names & Synonyms

  • DOAKLVKFURWEDJ-RWDRXURGSA-N
  • MFCD08282794
  • C72H101N17O26
  • (3S)-3-[[(2S)-4-amino-2-[[(2S)-2-(decanoylamino)-3-(1H-indol-3-yl)propanoyl]amino]-4-oxo-butanoyl]amino]-4-[[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-aminophenyl)-2-oxo-ethyl]-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-[(1R)-2-carboxy-1-methyl-ethyl]-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacont-30-yl]amino]-4-oxo-butanoic acid
  • 103060-53-3