Mal-NH-PEG10-CH2CH2COOPFP ester
HIT212667932
sdf文件结构编辑类似物检索
HIT ID: HIT212667932
Cas No:
分子式: C36H51F5N2O15
分子量: 846.795
常用名: Mal-NH-PEG10-CH2CH2COOPFP ester
氢键受体数 (HBA): 14
氢键供体数 (HBD): 1
LogP: 0.4821058
IUPAC: 2,3,4,5,6-pentafluorophenyl 1-[3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamido]-3,6,9,12,15,18,21,24,27,30-decaoxatritriacontan-33-oate
IUPAC: 2,3,4,5,6-pentafluorophenyl 1-[3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamido]-3,6,9,12,15,18,21,24,27,30-decaoxatritriacontan-33-oate
SMILES: Fc1c(F)c(F)c(OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCN2C(=O)C=CC2=O)c(F)c1F |c:50|
SMILES: Fc1c(F)c(F)c(OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCN2C(=O)C=CC2=O)c(F)c1F |c:50|
InChI key: WPNLFPWCKSAWRX-UHFFFAOYSA-N
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