化学式

CAS号

IUPAC Name

[(1S,2S,3R,4S,7R,9S,10S,12R,15R,16S)-4-乙酰氧基-9,12-二羟基-15-[(2R,3S)-2-羟基-3-[(2-甲基-2-基)oxycarbonylamino]-3-phenylpropanoyl]氧基-10,14,20,20-四甲基-11,18-二氧代-5,6,17,19-tetraoxapentacyclo[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-9,12-dihydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,14,20,20-tetramethyl-11,18-dioxo-5,6,17,19-tetraoxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-2-yl] benzoate

InChI

InChI=1S/C43H49NO17/c1-20-26-28(47)32(49)41(8)24(46)19-25-43(61-60-25,57-21(2)45)31(41)34(55-35(50)23-17-13-10-14-18-23)42(40(26,6)7)33(56-38(53)59-42)30(20)54-36(51)29(48)27(22-15-11-9-12-16-22)44-37(52)58-39(3,4)5/h9-18,24-25,27-31,33-34,46-48H,19H2,1-8H3,(H,44,52)/t24-,25+,27-,28+,29+,30+,31-,33-,34-,41+,42+,43+/m0/s1

InChI Key

YMZYFTRBDNOFLF-GMYODHQSSA-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)(OO4)OC(=O)C)O)C)O

别名

• SCHEMBL17666250