HIT ID: HIT218832693

Cas No:

分子式: C43H73N5O8

分子量: 788.084

常用名: tert-butyl 2-(2-{[1-(4-{N,3-dimethyl-2-[3-methyl-2-(methylamino)butanamido]butanamido}-3-methoxy-5-methylheptanoyl)pyrrolidin-2-yl](methoxy)methyl}propanamido)-3-phenylpropanoate, MMAF-OtBu

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: tert-butyl 2-(2-{[1-(4-{N,3-dimethyl-2-[3-methyl-2-(methylamino)butanamido]butanamido}-3-methoxy-5-methylheptanoyl)pyrrolidin-2-yl](methoxy)methyl}propanamido)-3-phenylpropanoate

SMILES: CCC(C)C(C(CC(=O)N1CCCC1C(OC)C(C)C(=O)NC(Cc1ccccc1)C(=O)OC(C)(C)C)OC)N(C)C(=O)C(NC(=O)C(NC)C(C)C)C(C)C

InChI key: HMBFRLXQUOOKLK-UHFFFAOYSA-N