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)-3-(dimethylcarbamoylamino)-2-羟基-3-phenylpropanoyl]氧基-12-(dimethylcarbamoyloxy)-9-甲氧基-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-15-[(2R,3S)-3-(dimethylcarbamoylamino)-2-hydroxy-3-phenylpropanoyl]oxy-12-(dimethylcarbamoyloxy)-9-methoxy-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/C47H57N3O15/c1-24-30-34(61-42(57)50(8)9)36(53)45(5)29(59-10)23-28-21-22-46(28,64-25(2)51)35(45)38(62-39(54)27-19-15-12-16-20-27)47(44(30,3)4)37(63-43(58)65-47)33(24)60-40(55)32(52)31(48-41(56)49(6)7)26-17-13-11-14-18-26/h11-20,28-29,31-35,37-38,52H,21-23H2,1-10H3,(H,48,56)/t28-,29+,31+,32-,33-,34-,35+,37+,38+,45-,46+,47-/m1/s1

InChI Key

UBTXCTRIYQEGQX-MWDZRXABSA-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)N(C)C)O)OC(=O)O5)OC(=O)C7=CC=CC=C7)OC(=O)C)OC)C)OC(=O)N(C)C

别名

• SCHEMBL18251607