Mal-PEG4-Val-Cit-PAB-OH
HIT214314893
sdf文件结构编辑类似物检索
HIT ID: HIT214314893
Cas No: 2055041-39-7
分子式: C33H50N6O11
分子量: 706.794
常用名: Mal-PEG4-Val-Cit-PAB-OH
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-[(1S)-1-{[(1S)-4-(carbamoylamino)-1-{[4-(hydroxymethyl)phenyl]carbamoyl}butyl]carbamoyl}-2-methylpropyl]-1-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-3,6,9,12-tetraoxapentadecan-15-amide
IUPAC: N-[(1S)-1-{[(1S)-4-(carbamoylamino)-1-{[4-(hydroxymethyl)phenyl]carbamoyl}butyl]carbamoyl}-2-methylpropyl]-1-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-3,6,9,12-tetraoxapentadecan-15-amide
SMILES: CC(C)[C@H](NC(=O)CCOCCOCCOCCOCCN1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1 |c:24,@@:1|
SMILES: CC(C)[C@H](NC(=O)CCOCCOCCOCCOCCN1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1 |c:24,@@:1|
InChI key: RFGYJIMAJDHMSQ-YZNIXAGQSA-N
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