N-[(2S)-2-Methoxy-3-[(2R,3R,3aS,7R,8aS,9S,10aR,11S,12R,13aR,13bS,15S,18S,21S,24S,26R,28R,29aS)-octacosahydro-3-methoxy-26-methyl-20,27-bis(methylene)-5-oxo-11,15:18,21:24,28-triepoxy-7,9-ethano-12,15-methano-9H,15H-furo[3,2-i]furo[2′,3′:5,6]pyrano[4,3-b][1,4]dioxacyclopentacosin-2-yl]propyl]glycine butyl ester (ACI)
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Basic information
| GHS | |
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| Smiles | C=C1[C@@]2([H])O[C@@]([H])(CC[C@@]34C[C@@]5([H])O[C@]6([H])[C@@]([H])(O[C@@]7([H])CC[C@]([H])(CC(C[C@]8([H])[C@@H](OC)[C@@H](C[C@H](OC)CNCC(=O)OCCCC)O[C@@]8([H])C[C@]8([H])C(=C)[C@H](C)C[C@]([H])(CC2)O8)=O)O[C@]7([H])[C@]6([H])O3)[C@@]5([H])O4)C1 |
| Inchi | InChI=1S/C47H71NO13/c1-7-8-15-53-40(50)24-48-23-32(51-5)20-38-41(52-6)33-19-28(49)18-30-10-12-35-42(56-30)46-45-44(58-35)43-39(59-45)22-47(60-43,61-46)14-13-31-17-26(3)34(54-31)11-9-29-16-25(2)27(4)36(55-29)21-37(33)57-38/h25,29-39,41-46,48H,3-4,7-24H2,1-2,5-6H3/t25-,29+,30-,31+,32+,33+,34+,35+,36-,37+,38-,39-,41-,42+,43+,44+,45-,46+,47+/m1/s1 |
| InchiKey | RSXRCUPULDCOID-MGSMGJRWSA-N |
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