Lactucin

CAS Registry Number®

1891-29-8
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CAS Name

Lactucin

Molecular Formula

C15H16O5

Molecular Mass

276.28

Cite this Page

Lactucin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1891-29-8 (retrieved 2024-04-25) (CAS RN: 1891-29-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    226 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C15H16O5/c1-6-3-9(17)12-7(2)15(19)20-14(12)13-8(5-16)4-10(18)11(6)13/h4,9,12-14,16-17H,2-3,5H2,1H3/t9-,12+,13-,14-/m0/s1

InChIKey

InChIKey=VJQAFLAZRVKAKM-VZLIPTOUSA-N

SMILES

C(O)C=1[C@@]2([C@@]3([C@](C(=C)C(=O)O3)([C@@H](O)CC(C)=C2C(=O)C1)[H])[H])[H]

Canonical SMILES

O=C1OC2C3C(C(=O)C=C3CO)=C(C)CC(O)C2C1=C

Other Names for this Substance

  • Azuleno[4,5-b]furan-2,7-dione, 3,3a,4,5,9a,9b-hexahydro-4-hydroxy-9-(hydroxymethyl)-6-methyl-3-methylene-, (3aR,4S,9aS,9bR)-
  • Lactucin
  • Azuleno[4,5-b]furan-2,7-dione, 3,3a,4,5,9a,9b-hexahydro-4-hydroxy-9-(hydroxymethyl)-6-methyl-3-methylene-, [3aR-(3aα,4β,9aα,9bβ)]-
  • (3aR,4S,9aS,9bR)-3,3a,4,5,9a,9b-Hexahydro-4-hydroxy-9-(hydroxymethyl)-6-methyl-3-methyleneazuleno[4,5-b]furan-2,7-dione
  • Lactucine

Deleted or Replaced CAS Registry Numbers

1400-19-7, 81241-45-4

CAS INSIGHTSTM
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