化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,10S,11S,12R,15R,16S)-4-乙酰氧基-9,11,12-三羟基-15-[(2R,3R)-2-羟基-3-(3-methylidenepenta-1,4-二烯-2-基氨基)-3-噻吩-2-ylpropanoyl]氧基-10,14,20,20-四甲基-18-氧代-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-烯-2-基]苯甲酸 [(1S,2S,3R,4S,7R,9S,10S,11S,12R,15R,16S)-4-acetyloxy-9,11,12-trihydroxy-15-[(2R,3R)-2-hydroxy-3-(3-methylidenepenta-1,4-dien-2-ylamino)-3-thiophen-2-ylpropanoyl]oxy-10,14,20,20-tetramethyl-18-oxo-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C43H49NO14S/c1-9-20(2)22(4)44-29(25-16-13-17-59-25)31(48)38(51)54-32-21(3)28-30(47)34(49)41(8)26(46)18-27-42(19-53-27,57-23(5)45)33(41)36(55-37(50)24-14-11-10-12-15-24)43(40(28,6)7)35(32)56-39(52)58-43/h9-17,26-27,29-36,44,46-49H,1-2,4,18-19H2,3,5-8H3/t26-,27+,29-,30+,31+,32+,33-,34+,35-,36-,41+,42-,43+/m0/s1

InChI Key

IJXMEINFORDYBW-OWNPLHSKSA-N

Canonical SMILES

CC1=C2C(C(C3(C(CC4C(C3C(C5(C2(C)C)C(C1OC(=O)C(C(C6=CC=CS6)NC(=C)C(=C)C=C)O)OC(=O)O5)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)O)O

别名