| SpectraBase Spectrum ID |
JblJcLnyuoN |
| Name |
(+)-Ptaquilosin |
| Alternate Name(s) |
(3'aS,4'S,7'aR)-4',7'a-dihydroxy-2',4',6'-trimethyl-1',2',3',3'a,4',7'a-hexahydrospiro[cyclopropane-1,5'-indene]-3'-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O3 |
| InChI |
InChI=1S/C14H20O3/c1-8-6-14(17)7-9(2)13(4-5-13)12(3,16)11(14)10(8)15/h7-8,11,16-17H,4-6H2,1-3H3/t8?,11-,12+,14-/m1/s1 |
| InChIKey |
HDWVDSGSKCEKMA-MBJFHXGBSA-N |
| Molecular Weight |
236.311 g/mol |
| SMILES |
O[C@@]12CC(C([C@@]1([C@@](C1(C(=C2)C)CC1)(O)C)[H])=O)C |
| SPLASH |
splash10-000j-0960000000-f54665771466be7c41bc |
| Source of Spectrum |
C-115-3064-2 |
| Wiley ID |
1238452 |
