HIT ID: HIT214323034
Cas No: 2098497-25-5
分子式: C36H67ClF3N11O7
分子量: 858.45
常用名: Decanoyl-RVKR-CMK TFA
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-[(1S)-1-{[(1S)-1-{[(1R)-5-amino-1-{[(3S)-6-carbamimidamido-1-chloro-2-oxohexan-3-yl]carbamoyl}pentyl]carbamoyl}-2-methylpropyl]carbamoyl}-4-carbamimidamidobutyl]decanamide; trifluoroacetic acid
IUPAC: N-[(1S)-1-{[(1S)-1-{[(1R)-5-amino-1-{[(3S)-6-carbamimidamido-1-chloro-2-oxohexan-3-yl]carbamoyl}pentyl]carbamoyl}-2-methylpropyl]carbamoyl}-4-carbamimidamidobutyl]decanamide; trifluoroacetic acid
SMILES: OC(=O)C(F)(F)F.CCCCCCCCCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)CCl |@:31|
SMILES: OC(=O)C(F)(F)F.CCCCCCCCCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)CCl |@:31|
InChI key: QYMXBIIZDOWKAX-GRDOVIKDSA-N
