Name: 4A3-SC8
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT217583285
Cas No:1857340-78-3
常用名:4A3-SC8
别名:4A3SC8, 4A3 SC8
IUPAC:2-{[3-({3-[(3-{bis[3-(2-{[2-methyl-3-(octylsulfanyl)propanoyl]oxy}ethoxy)-3-oxopropyl]amino}propyl)(methyl)amino]propyl}[3-(2-{[2-methyl-3-(octylsulfanyl)propanoyl]oxy}ethoxy)-3-oxopropyl]amino)propanoyl]oxy}ethyl 2-methyl-3-(octylsulfanyl)propanoate
IUPAC:2-{[3-({3-[(3-{bis[3-(2-{[2-methyl-3-(octylsulfanyl)propanoyl]oxy}ethoxy)-3-oxopropyl]amino}propyl)(methyl)amino]propyl}[3-(2-{[2-methyl-3-(octylsulfanyl)propanoyl]oxy}ethoxy)-3-oxopropyl]amino)propanoyl]oxy}ethyl 2-methyl-3-(octylsulfanyl)propanoate
InChI key:HMIDEMNFLBUNTB-UHFFFAOYSA-N

分子式:C75H139N3O16S4
分子量:1467.18
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCCCCCCCSCC(C)C(=O)OCCOC(=O)CCN(CCCN(C)CCCN(CCC(=O)OCCOC(=O)C(C)CSCCCCCCCC)CCC(=O)OCCOC(=O)C(C)CSCCCCCCCC)CCC(=O)OCCOC(=O)C(C)CSCCCCCCCC
SMILES:CCCCCCCCSCC(C)C(=O)OCCOC(=O)CCN(CCCN(C)CCCN(CCC(=O)OCCOC(=O)C(C)CSCCCCCCCC)CCC(=O)OCCOC(=O)C(C)CSCCCCCCCC)CCC(=O)OCCOC(=O)C(C)CSCCCCCCCC

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