化学式

CAS号

IUPAC Name

[(1S,2S,4S,7R,9S,10S,12R,15R,16S)-4-乙酰氧基-12-(cyclopropanecarbonyloxy)-9-羟基-15-[(2R,3S)-2-羟基-5-甲基-3-[(2-甲基-2-基)oxycarbonylamino]hexanoyl]氧基-10,14,20,20-四甲基-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,4S,7R,9S,10S,12R,15R,16S)-4-acetyloxy-12-(cyclopropanecarbonyloxy)-9-hydroxy-15-[(2R,3S)-2-hydroxy-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]oxy-10,14,20,20-tetramethyl-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/C46H59NO17/c1-21(2)18-26(47-40(55)63-42(5,6)7)30(50)39(54)58-31-22(3)29-32(59-37(52)25-16-17-25)34(51)44(10)27(49)19-28-45(20-57-28,62-23(4)48)33(44)36(60-38(53)24-14-12-11-13-15-24)46(43(29,8)9)35(31)61-41(56)64-46/h11-15,21,25-28,30-33,35-36,49-50H,16-20H2,1-10H3,(H,47,55)/t26-,27-,28+,30+,31+,32+,33?,35-,36-,44+,45-,46+/m0/s1

InChI Key

HXAPAQABASIBQB-JLGSVQAYSA-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)OC(=O)C)O)C)OC(=O)C7CC7

别名