$120.00
| CAS No.: | 509-20-6 |
| Molecular Formula | C₂₅H₄₁NO₉ |
| Molecular Weight | 499.6g/mol |
| Purity | HPLC>98% |
| Chemical Family | Alkaloids |
| Weight |
|---|
IUPAC Name: (1S,2R,3R,4R,5R,6S,7S,8R,9R,13R,14R,16S,17S,18R)-11-ethyl-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,5,7,8,14-pentol
InChI: InChI=1S/C25H41NO9/c1-6-26-9-22(10-32-2)12(27)7-13(33-3)24-11-8-23(30)19(28)14(11)25(31,20(29)21(23)35-5)15(18(24)26)16(34-4)17(22)24/h11-21,27-31H,6-10H2,1-5H3/t11-,12-,13+,14-,15+,16+,17-,18?,19-,20+,21+,22+,23-,24+,25-/m1/s1
InChIKey: SQMGCPHFHQGPIF-JIOYIOPFSA-N
Canonical SMILES: CCN1CC2(C(CC(C34C2C(C(C31)C5(C6C4CC(C6O)(C(C5O)OC)O)O)OC)OC)O)COC
Isomeric SMILES: CCN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@@]5([C@@H]6[C@H]4C[C@@]([C@@H]6O)([C@H]([C@@H]5O)OC)O)O)OC)OC)O)COC
Synonyms: Aconine; Jesaconine; 509-20-6; SCHEMBL1643263; CHEBI:132639; SQMGCPHFHQGPIF-JIOYIOPFSA-N; HY-N0277; CS-3591; …
Botanical Source: Aconitum carmichaelii Debx.
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