Lactucopicrin
CAS Registry Number®
65725-11-3
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CAS Name
LactucopicrinMolecular Formula
C23H22O7Molecular Mass
410.42Cite this Page
Lactucopicrin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=65725-11-3 (retrieved ) (CAS RN: 65725-11-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
146 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C23H22O7/c1-11-7-17(29-18(27)8-13-3-5-15(25)6-4-13)20-12(2)23(28)30-22(20)21-14(10-24)9-16(26)19(11)21/h3-6,9,17,20-22,24-25H,2,7-8,10H2,1H3/t17-,20+,21-,22-/m0/s1
InChIKey
InChIKey=UMVSOHBRAQTGQI-XGARDCMYSA-N
SMILES
C(O)C=1[C@@]2([C@@]3([C@@]([C@@H](OC(CC4=CC=C(O)C=C4)=O)CC(C)=C2C(=O)C1)(C(=C)C(=O)O3)[H])[H])[H]
Canonical SMILES
O=C1OC2C3C(C(=O)C=C3CO)=C(C)CC(OC(=O)CC4=CC=C(O)C=C4)C2C1=C
Other Names for this Substance
- Benzeneacetic acid, 4-hydroxy-, (3aR,4S,9aS,9bR)-2,3,3a,4,5,7,9a,9b-octahydro-9-(hydroxymethyl)-6-methyl-3-methylene-2,7-dioxoazuleno[4,5-b]furan-4-yl ester
- Benzeneacetic acid, 4-hydroxy-, 2,3,3a,4,5,7,9a,9b-octahydro-9-(hydroxymethyl)-6-methyl-3-methylene-2,7-dioxoazuleno[4,5-b]furan-4-yl ester, [3aR-(3aα,4α,9aα,9bβ)]-
- Lactucin, (p-hydroxyphenyl)acetate
- Azuleno[4,5-b]furan, benzeneacetic acid deriv.
- Lactupicrin
Deleted or Replaced CAS Registry Numbers
81249-29-8