SpectraBase Spectrum ID |
DE7EFtJfqpY |
Name |
Cyclonona[c]pyran-3(1H)-one, 4,4a,5,6,9,10,11,11a-octahydro-7-methyl-11-methylene-4-(4-methyl-1,3- pentadienyl)-, [4R*(E),4aR*,7E,11aS*]-(+)- |
CAS Registry Number |
80433-13-2 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H28O2 |
InChI |
InChI=1S/C20H28O2/c1-14(2)7-5-10-18-17-12-11-15(3)8-6-9-16(4)19(17)13-22-20(18)21/h5,7-8,10,14,17,19H,4,6,9,11-13H2,1-3H3/b7-5+,15-8-,18-10- |
InChIKey |
JIMPLIPTKQIYKW-IPXMZJMNSA-N |
Molecular Weight |
300.442 g/mol |
SMILES |
C1(\C(C2C(C(CC\C=C/(CC2)C)=C)CO1)=C/C=C/C(C)C)=O |
SPLASH |
splash10-0udi-0039000000-396e6834667896c31d02 |
Source of Spectrum |
F-37-2730-0 |
Synonyms |
(4Z)-7-methyl-11-methylene-4-[(2E)-4-methyl-2-pentenylidene]-4,4a,5,6,9,10,11,11a-octahydrocyclonona[c]pyran-3(1H)-one
Coraxeniolide D |
Wiley ID |
1303340 |