化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4-乙酰氧基-9,12-二羟基-15-[(2R,3S)-2-羟基-3-[(2-甲基-2-基)oxycarbonylamino]-3-phenylpropanoyl]氧基-10,14,20,20-四甲基-11,18-二氧代-17,19-dioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-烯-2-基]苯甲酸 [(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4-acetyloxy-9,12-dihydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,14,20,20-tetramethyl-11,18-dioxo-17,19-dioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C45H53NO15/c1-22-28-30(49)34(51)43(8)27(48)21-26-19-20-44(26,59-23(2)47)33(43)36(57-37(52)25-17-13-10-14-18-25)45(42(28,6)7)35(58-40(55)61-45)32(22)56-38(53)31(50)29(24-15-11-9-12-16-24)46-39(54)60-41(3,4)5/h9-18,26-27,29-33,35-36,48-50H,19-21H2,1-8H3,(H,46,54)/t26-,27+,29+,30-,31-,32-,33+,35+,36+,43-,44+,45-/m1/s1

InChI Key

CCODRPPGHIXJEI-MBWHSCINSA-N

Canonical SMILES

CC1=C2C(C(=O)C3(C(CC4CCC4(C3C(C5(C2(C)C)C(C1OC(=O)C(C(C6=CC=CC=C6)NC(=O)OC(C)(C)C)O)OC(=O)O5)OC(=O)C7=CC=CC=C7)OC(=O)C)O)C)O

别名