化学式

CAS号

IUPAC Name

4-[4-[(1S,10S,14R)-6-(4-羧基-3-甲氧基-2,5,6-trimethylphenoxy)羰基-5-甲氧基-4,7,10,13,14-五甲基-11,16-二氧代-2,15,17-trioxatetracyclo[8.7.0.01,14.03,8]heptadeca-3,5,7,12-四烯-12-羰基]氧基-2-甲氧基-3,5,6-trimethylbenzoyl]氧基-2-甲氧基-3,5,6-三甲基苯甲酸 4-[4-[(1S,10S,14R)-6-(4-carboxy-3-methoxy-2,5,6-trimethylphenoxy)carbonyl-5-methoxy-4,7,10,13,14-pentamethyl-11,16-dioxo-2,15,17-trioxatetracyclo[8.7.0.01,14.03,8]heptadeca-3,5,7,12-tetraene-12-carbonyl]oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid

InChI

InChI=1S/C55H58O19/c1-20-23(4)38(27(8)42(65-15)33(20)47(57)58)69-49(61)35-22(3)25(6)40(29(10)44(35)67-17)71-51(63)37-31(12)54(14)55(74-52(64)73-54)53(13,46(37)56)19-32-26(7)36(45(68-18)30(11)41(32)72-55)50(62)70-39-24(5)21(2)34(48(59)60)43(66-16)28(39)9/h19H2,1-18H3,(H,57,58)(H,59,60)/t53-,54+,55-/m0/s1

InChI Key

ZURWFIQIBDSOLV-ZVGCCQDVSA-N

Canonical SMILES

CC1=C(C(=C(C(=C1C(=O)O)OC)C)OC(=O)C2=C(C(=C(C(=C2C)C)OC(=O)C3=C(C4(C5(C(C3=O)(CC6=C(C(=C(C(=C6O5)C)OC)C(=O)OC7=C(C(=C(C(=C7C)C)C(=O)O)OC)C)C)C)OC(=O)O4)C)C)C)OC)C

别名

• 2,3,5-Trimethyl-4-[2,3,5-trimethyl-4-[[(4R)-1,12-dioxo-3,4,5,8,9aalpha-pentamethyl-6-methoxy-7-(2,3,6-trimethyl-4-carboxy-5-methoxyphenoxycarbonyl)-4beta,4abeta-(epoxymethanoxy)-4,4a,9,9a-tetrahydro-1H-xanthene-2-yl]carbonyloxy]-6-methoxybenzoyloxy]-6-methoxybenzoic acid