化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,12R,15R,16S)-4-乙酰氧基-15-[(2R,3S)-3-(dimethylcarbamoylamino)-2-羟基-3-phenylpropanoyl]氧基-9,12-二甲氧基-14,20,20-三甲基-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,12R,15R,16S)-4-acetyloxy-15-[(2R,3S)-3-(dimethylcarbamoylamino)-2-hydroxy-3-phenylpropanoyl]oxy-9,12-dimethoxy-14,20,20-trimethyl-11,18-dioxo-17,19-dioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C44H52N2O14/c1-22-29-35(55-8)32(48)28-27(54-7)21-26-19-20-43(26,59-23(2)47)30(28)36(57-38(50)25-17-13-10-14-18-25)44(42(29,3)4)37(58-41(53)60-44)34(22)56-39(51)33(49)31(45-40(52)46(5)6)24-15-11-9-12-16-24/h9-18,26-28,30-31,33-37,49H,19-21H2,1-8H3,(H,45,52)/t26-,27+,28?,30-,31+,33-,34-,35-,36+,37+,43+,44+/m1/s1

InChI Key

BUGBJPWDTXMOGI-GQHAJGEASA-N

Canonical SMILES

CC1=C2C(C(=O)C3C(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)OC

别名

• SCHEMBL18251610