Butanoic acid, 3-methyl-, 6,7a-dihydro-4-[(3-hydroxy-3-methyl-1-oxobutoxy)methyl]spiro[cyclopenta[c]pyran-7(1H),2′-oxirane]-1,6-diyl ester
CAS Registry Number®
96681-66-2
CAS Name
Butanoic acid, 3-methyl-, 6,7a-dihydro-4-[(3-hydroxy-3-methyl-1-oxobutoxy)methyl]spiro[cyclopenta[c]pyran-7(1H),2′-oxirane]-1,6-diyl esterMolecular Formula
C25H36O9Molecular Mass
480.55Cite this Page
Butanoic acid, 3-methyl-, 6,7a-dihydro-4-[(3-hydroxy-3-methyl-1-oxobutoxy)methyl]spiro[cyclopenta[c]pyran-7(1H),2′-oxirane]-1,6-diyl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=96681-66-2 (retrieved ) (CAS RN: 96681-66-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C25H36O9/c1-14(2)7-19(26)33-18-9-17-16(11-30-21(28)10-24(5,6)29)12-31-23(22(17)25(18)13-32-25)34-20(27)8-15(3)4/h9,12,14-15,18,22-23,29H,7-8,10-11,13H2,1-6H3
InChIKey
InChIKey=QHYRSOLVOPZTHU-UHFFFAOYSA-N
SMILES
O(C(CC(C)C)=O)C1C2(C3C(=C1)C(COC(CC(C)(C)O)=O)=COC3OC(CC(C)C)=O)CO2
Canonical SMILES
O=C(OCC1=COC(OC(=O)CC(C)C)C2C1=CC(OC(=O)CC(C)C)C32OC3)CC(O)(C)C
Other Names for this Substance
- Butanoic acid, 3-methyl-, 6,7a-dihydro-4-[(3-hydroxy-3-methyl-1-oxobutoxy)methyl]spiro[cyclopenta[c]pyran-7(1H),2′-oxirane]-1,6-diyl ester
- Spiro[cyclopenta[c]pyran-7(1H),2′-oxirane], butanoic acid deriv.