化学式

CAS号

IUPAC Name

[(1S,2S,4R,7R,9S,10S,12R,15R,16S)-12-乙酰氧基-9-羟基-15-[(2R,3S)-2-羟基-5-甲基-3-[(2-甲基-2-基)oxycarbonylamino]hexanoyl]氧基-4,10,14,20,20-五甲基-11,18-二氧代-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-烯-2-基]苯甲酸 [(1S,2S,4R,7R,9S,10S,12R,15R,16S)-12-acetyloxy-9-hydroxy-15-[(2R,3S)-2-hydroxy-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]oxy-4,10,14,20,20-pentamethyl-11,18-dioxo-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C43H57NO15/c1-20(2)17-24(44-37(51)58-39(5,6)7)28(47)36(50)55-29-21(3)27-30(54-22(4)45)32(48)42(11)25(46)18-26-41(10,19-53-26)31(42)34(56-35(49)23-15-13-12-14-16-23)43(40(27,8)9)33(29)57-38(52)59-43/h12-16,20,24-26,28-31,33-34,46-47H,17-19H2,1-11H3,(H,44,51)/t24-,25-,26+,28+,29+,30+,31?,33-,34-,41+,42+,43+/m0/s1

InChI Key

UBDGZEZPZUMELR-GWERRFKYSA-N

Canonical SMILES

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

别名

• SCHEMBL10028902