化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4-乙酰氧基-15-[(2R,3S)-2-羟基-3-[(2-甲基-2-基)oxycarbonylamino]-3-phenylpropanoyl]氧基-9,12-二甲氧基-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,3R,4S,7R,9S,10S,12R,15R,16S)-4-acetyloxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-9,12-dimethoxy-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/C46H55NO16/c1-23-29-33(56-10)35(50)44(8)27(55-9)21-28-45(22-57-28,61-24(2)48)34(44)37(59-38(51)26-19-15-12-16-20-26)46(43(29,6)7)36(60-41(54)63-46)32(23)58-39(52)31(49)30(25-17-13-11-14-18-25)47-40(53)62-42(3,4)5/h11-20,27-28,30-34,36-37,49H,21-22H2,1-10H3,(H,47,53)/t27-,28+,30-,31+,32+,33+,34-,36-,37-,44+,45-,46+/m0/s1

InChI Key

FTCXJADVMHXSQS-MFZGBUFDSA-N

Canonical SMILES

CC1=C2C(C(=O)C3(C(CC4C(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)(CO4)OC(=O)C)OC)C)OC

别名

• CHEMBL3098555
• SCHEMBL16748654