$75.00
| CAS No.: | 548-37-8 |
| Molecular Formula | C₁₇H₂₄O₁₀ |
| Molecular Weight | 388.4g/mol |
| Purity | HPLC>98% |
| Chemical Family | Iridoids |
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IUPAC Name: methyl (1S,4aS,7S,7aR)-7-methyl-5-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,6,7,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate
InChI: InChI=1S/C17H24O10/c1-6-3-8(19)11-7(15(23)24-2)5-25-16(10(6)11)27-17-14(22)13(21)12(20)9(4-18)26-17/h5-6,9-14,16-18,20-22H,3-4H2,1-2H3/t6-,9+,10+,11-,12+,13-,14+,16-,17-/m0/s1
InChIKey: HLXRWTJXGMHOFN-XJSNKYLASA-N
Canonical SMILES: CC1CC(=O)C2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O
Isomeric SMILES: C[C@H]1CC(=O)[C@H]2[C@@H]1[C@@H](OC=C2C(=O)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
Synonyms: Verbenalin; Cornin; 548-37-8; Verbenaloside; Cornin (glycoside); CHEBI:9954; 71B68181Z6; cornin iridoid; …
Botanical Source: Verbena Officinalis L.
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