| SpectraBase Spectrum ID |
8zdYV2Xwxep |
| Name |
Laevigatlactone B |
| Appearance |
Colorless prism |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O3 |
| InChI |
InChI=1S/C20H30O3/c1-15(2)20-12-10-17(18(21)23-20)9-5-7-16(3)8-6-11-19(4,22)13-14-20/h8-9,13-15,22H,5-7,10-12H2,1-4H3/b14-13+,16-8+,17-9-/t19-,20-/m0/s1 |
| InChIKey |
GZRPXVDWKSUPJN-MOLDTNGJSA-N |
| Instrument Name |
GCMS-QP 2010 Shimadzu |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np100044t |
| Molecular Weight |
318.457 g/mol |
| Optical Rotation |
[a]D25 = -1.63 (c = 0.06, MeOH) |
| Reported Formula |
C20H30O3 |
| SMILES |
O[C@]1(CC\C=C/(C)CC\C=C\2CC[C@](\C=C\1)(C(C)C)OC2=O)C |
| SPLASH |
splash10-052f-9310000000-98a23ef5df42b3c28d96 |
| Source of Spectrum |
G4-73-795-2 |
| Wiley ID |
1848948 |
![LAEVIGATLACTONE_B;(1-R*,2-E,4-S*,7-E,11-Z)-1-ISOPROPYL-4-HYDROXY-4,8-DIMETHYL-21-OXABICYCLO-[10.2.2]-HEXADECA-2,7,11-TRIEN-20-ONE](/api/spectrum/8zdYV2Xwxep/structure.png?h=300&w=458 "LAEVIGATLACTONE_B;(1-R*,2-E,4-S*,7-E,11-Z)-1-ISOPROPYL-4-HYDROXY-4,8-DIMETHYL-21-OXABICYCLO-[10.2.2]-HEXADECA-2,7,11-TRIEN-20-ONE")
