化学式

CAS号

IUPAC Name

[(4R)-8-[(8S,10S,17S,18S)-8-(5-乙酰氧基-4-羟基-4,6-dimethyloxan-2-基)氧基-19-(二甲氧基甲基)-10,13-二羟基-6-甲氧基-3-甲基-11-氧代螺[16,20,22-trioxahexacyclo[17.2.1.02,15.05,14.07,12.017,21]docosa-2(15),3,5(14),6,12-五烯-18,2'-环氧乙烷]-17-基]氧基-4,10-二甲基-2-氧代-1,3,9-trioxaspiro[4.5]癸烷-6-基]乙 [(4R)-8-[(8S,10S,17S,18S)-8-(5-acetyloxy-4-hydroxy-4,6-dimethyloxan-2-yl)oxy-19-(dimethoxymethyl)-10,13-dihydroxy-6-methoxy-3-methyl-11-oxospiro[16,20,22-trioxahexacyclo[17.2.1.02,15.05,14.07,12.017,21]docosa-2(15),3,5(14),6,12-pentaene-18,2'-oxirane]-17-yl]oxy-4,10-dimethyl-2-oxo-1,3,9-trioxaspiro[4.5]decan-6-yl] acetate

InChI

InChI=1S/C45H54O22/c1-16-11-22-29(33(50)31-30(34(22)53-8)24(12-23(48)32(31)49)62-27-14-41(7,52)37(17(2)57-27)61-21(6)47)35-28(16)36-38-44(64-35,42(15-56-42)45(65-36,66-38)39(54-9)55-10)63-26-13-25(60-20(5)46)43(18(3)58-26)19(4)59-40(51)67-43/h11,17-19,23-27,36-39,48,50,52H,12-15H2,1-10H3/t17?,18?,19-,23+,24+,25?,26?,27?,36?,37?,38?,41?,42+,43?,44-,45?/m1/s1

InChI Key

WQMHALPBMICINM-CDUSJUGXSA-N

Canonical SMILES

CC1C(C(CC(O1)OC2CC(C(=O)C3=C(C4=C(C=C(C5=C4OC6(C7C5OC(C68CO8)(O7)C(OC)OC)OC9CC(C1(C(O9)C)C(OC(=O)O1)C)OC(=O)C)C)C(=C23)OC)O)O)(C)O)OC(=O)C

别名

• SCHEMBL20671519