化学式

CAS号

IUPAC Name

(1R,2R,5R,7R,8R,9R,11R,12E,13S,14R)-12-[(E)-3-(5-benzoylthiophen-2-基)丙-2-enoxy]亚氨基-8-[(2S,3R,4S,6R)-4-(二甲基氨基)-3-羟基-6-methyloxan-2-基]氧基-2-乙基-9-甲氧基-1,5,7,9,11,13-六甲基-3,15,17-trioxabicyclo[12.3.0]十七烷-4,6,16-三酮 (1R,2R,5R,7R,8R,9R,11R,12E,13S,14R)-12-[(E)-3-(5-benzoylthiophen-2-yl)prop-2-enoxy]imino-8-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-9-methoxy-1,5,7,9,11,13-hexamethyl-3,15,17-trioxabicyclo[12.3.0]heptadecane-4,6,16-trione

InChI

InChI=1S/C45H62N2O12S/c1-12-34-45(8)40(58-43(52)59-45)27(4)35(46-54-22-16-19-31-20-21-33(60-31)37(49)30-17-14-13-15-18-30)25(2)24-44(7,53-11)39(28(5)36(48)29(6)41(51)56-34)57-42-38(50)32(47(9)10)23-26(3)55-42/h13-21,25-29,32,34,38-40,42,50H,12,22-24H2,1-11H3/b19-16+,46-35+/t25-,26-,27+,28+,29-,32+,34-,38-,39-,40-,42+,44-,45-/m1/s1

InChI Key

HZHRUHYXOKBTOR-FPOOGBMESA-N

Canonical SMILES

CCC1C2(C(C(C(=NOCC=CC3=CC=C(S3)C(=O)C4=CC=CC=C4)C(CC(C(C(C(=O)C(C(=O)O1)C)C)OC5C(C(CC(O5)C)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• CHEMBL2336791