HIT ID: HIT218643231

Cas No:

分子式: C43H51NO13

分子量: 789.875

常用名: 4-(acetyloxy)-1,9,12-trihydroxy-15-{[2-hydroxy-3-(2-methylbut-2-enamido)-3-phenylpropanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0^{3,10}.0^{4,7}]heptadec-13-en-2-yl benzoate, 10-Deacetylcephalomannine

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: 4-(acetyloxy)-1,9,12-trihydroxy-15-{[2-hydroxy-3-(2-methylbut-2-enamido)-3-phenylpropanoyl]oxy}-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.0^{3,10}.0^{4,7}]heptadec-13-en-2-yl benzoate

SMILES: CC=C(C)C(=O)NC(C(O)C(=O)OC1CC2(O)C(OC(=O)c3ccccc3)C3C4(COC4CC(O)C3(C)C(=O)C(O)C(=C1C)C2(C)C)OC(C)=O)c1ccccc1

InChI key: ADDGUHVEJPNWQZ-UHFFFAOYSA-N