Verbenalin
CAS Registry Number®
548-37-8
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CAS Name
VerbenalinMolecular Formula
C17H24O10Molecular Mass
388.37Cite this Page
Verbenalin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=548-37-8 (retrieved ) (CAS RN: 548-37-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
183 °C
Source(s)
Other Names and Identifiers
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
InChIKey=HLXRWTJXGMHOFN-XJSNKYLASA-N
SMILES
O([C@H]1[C@]2([C@@](C(C(OC)=O)=CO1)(C(=O)C[C@@H]2C)[H])[H])[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O
Canonical SMILES
O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C(=O)CC3C
Other Names for this Substance
- Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-5-oxo-, methyl ester, (1S,4aS,7S,7aR)-
- Verbenalin
- Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-5-oxo-, methyl ester, [1S-(1α,4aα,7α,7aα)]-
- Verbenaloside
- Cornin (glycoside)
Deleted or Replaced CAS Registry Numbers
1391-15-7
