Demethyloleuropein
CAS Registry Number®
52077-55-1
CAS Name
DemethyloleuropeinMolecular Formula
C24H30O13Molecular Mass
526.49Cite this Page
Demethyloleuropein. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=52077-55-1 (retrieved ) (CAS RN: 52077-55-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C24H30O13/c1-2-12-13(8-18(28)34-6-5-11-3-4-15(26)16(27)7-11)14(22(32)33)10-35-23(12)37-24-21(31)20(30)19(29)17(9-25)36-24/h2-4,7,10,13,17,19-21,23-27,29-31H,5-6,8-9H2,1H3,(H,32,33)/b12-2+/t13-,17+,19+,20-,21+,23-,24-/m0/s1
InChIKey
InChIKey=HKVGJQVJNQRJPO-VTDDDATNSA-N
SMILES
C(C(OCCC1=CC(O)=C(O)C=C1)=O)[C@H]2/C(=C\C)/[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(O)=O
Canonical SMILES
O=C(O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C(=CC)C1CC(=O)OCCC3=CC=C(O)C(O)=C3
Other Names for this Substance
- 2H-Pyran-4-acetic acid, 5-carboxy-3-ethylidene-2-(β-D-glucopyranosyloxy)-3,4-dihydro-, α-[2-(3,4-dihydroxyphenyl)ethyl] ester, (2S,3E,4S)-
- 2H-Pyran-4-acetic acid, 5-carboxy-3-ethylidene-2-(β-D-glucopyranosyloxy)-3,4-dihydro-, 2-(3,4-dihydroxyphenyl)ethyl ester, [2S-(2α,3E,4β)]-
- Demethyloleoeuropeine
- Oleoeuropein acid
- Demethyloleuropein