
| CAS Number | 70578-24-4 |
| Catalog Number | AG00FBG2(AGN-PC-0TYD0W) |
| Chemical Name | 3α,13-Dihydroxyforesaconitine |
| IUPAC Name | [8-acetyloxy-11-ethyl-5,14-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate |
| InChI | InChI=1S/C35H49NO11/c1-8-36-16-32(17-41-3)22(38)13-23(43-5)35-21-14-33(40)24(44-6)15-34(47-18(2)37,26(29(35)36)27(45-7)28(32)35)25(21)30(33)46-31(39)19-9-11-20(42-4)12-10-19/h9-12,21-30,38,40H,8,13-17H2,1-7H3 |
| InChI Key | LLEMSCWAKNQHHA-UHFFFAOYSA-N |
| MDL Number | MFCD00880612 |
| Molecular Formula | C35H49NO11 |
| Molecular Weight | 659.7637 |
| SMILES | O(C)[C@@H]1[C@@]23[C@]4([C@](COC)(CN(CC)[C@@]2([C@]([C@@H]4OC)([C@]5(OC(C)=O)[C@@]6([C@]3(C[C@@](O)([C@@H]6OC(=O)C7=CC=C(OC)C=C7)[C@@H](OC)C5)[H])[H])[H])[H])[C@H](O)C1)[H] |
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