HIT ID: HIT212875785
Cas No: 150113-99-8
分子式: C34H66ClN11O5
分子量: 744.42
常用名: Decanoyl-RVKR-CMK
氢键受体数 (HBA): 12
氢键供体数 (HBD): 11
LogP: 0.6554238
IUPAC: N-[(1S)-1-{[(1S)-1-{[(1S)-5-amino-1-{[(3S)-6-carbamimidamido-1-chloro-2-oxohexan-3-yl]carbamoyl}pentyl]carbamoyl}-2-methylpropyl]carbamoyl}-4-carbamimidamidobutyl]decanamide
IUPAC: N-[(1S)-1-{[(1S)-1-{[(1S)-5-amino-1-{[(3S)-6-carbamimidamido-1-chloro-2-oxohexan-3-yl]carbamoyl}pentyl]carbamoyl}-2-methylpropyl]carbamoyl}-4-carbamimidamidobutyl]decanamide
SMILES: 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
SMILES: 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
InChI key: NHBJTTGFHCHQHS-VZTVMPNDSA-N
