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化学结构 |
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化学式 |
C44H59NO16 |
CAS号 |
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IUPAC Name |
[(1S,3R,4S,7R,9S,10S,15R,16S)-4,12-二乙酰-9-羟基-10,14,20,20-四甲基-11,18-二氧代-2-苄氧基-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-烯-15-基](2R,3S)-2-羟基-5-甲基-3-[(2-甲基-2-基)oxycarbonylamino]己酸 [(1S,3R,4S,7R,9S,10S,15R,16S)-4,12-diacetyloxy-9-hydroxy-10,14,20,20-tetramethyl-11,18-dioxo-2-phenylmethoxy-6,17,19-trioxapentacyclo[11.6.1.01,16.03,10.04,7]icos-13-en-15-yl] (2R,3S)-2-hydroxy-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate |
InChI |
InChI=1S/C44H59NO16/c1-21(2)17-26(45-38(52)60-40(6,7)8)30(49)37(51)57-31-22(3)29-32(56-23(4)46)34(50)42(11)27(48)18-28-43(20-55-28,59-24(5)47)33(42)36(54-19-25-15-13-12-14-16-25)44(41(29,9)10)35(31)58-39(53)61-44/h12-16,21,26-28,30-33,35-36,48-49H,17-20H2,1-11H3,(H,45,52)/t26-,27-,28+,30+,31+,32?,33-,35-,36?,42+,43-,44+/m0/s1 |
InChI Key |
SGKUSSNVYDLLDP-KRVOGSDRSA-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)OCC6=CC=CC=C6)(CO4)OC(=O)C)O)C)OC(=O)C |
别名 |
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