$120.00
| CAS No.: | 509-15-9 |
| Molecular Formula | C₂₀H₂₂N₂O₂ |
| Molecular Weight | 322.4g/mol |
| Purity | HPLC>98% |
| Chemical Family | Alkaloids |
| Weight |
|---|
IUPAC Name: (1’R,2’S,3S,5’S,6’S,8’R,11’S)-2′-ethenyl-4′-methylspiro[1H-indole-3,7′-9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane]-2-one
InChI: InChI=1S/C20H22N2O2/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23)/t11-,13+,15+,16+,17-,19-,20-/m0/s1
InChIKey: NFYYATWFXNPTRM-QJICHLCESA-N
Canonical SMILES: CN1CC2(C3CC4C5(C2C1C3CO4)C6=CC=CC=C6NC5=O)C=C
Isomeric SMILES: CN1C[C@]2([C@@H]3C[C@@H]4[C@]5([C@H]2[C@H]1[C@H]3CO4)C6=CC=CC=C6NC5=O)C=C
Synonyms: GELSEMINE; 509-15-9; 5Y13A78Z72; NSC-21729; UNII-5Y13A78Z72; HSDB 3488; gelsemine free base; (+)-Gelsemine; …
Botanical Source: Gelsemium elegans
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