| SpectraBase Spectrum ID |
iSwIuQas2H |
| Name |
2-[14-(Methyl 12-methoxy-7-oxopodocarpa-8,11,13-trien-19-oate)]ethanoic acid |
| Alternate Name(s) |
(S)-8-Carboxymethyl-6-methoxy-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydro-phenanthrene-1-carboxylic acid methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H28O5 |
| InChI |
InChI=1S/C21H28O5/c1-20-8-5-9-21(2,19(24)26-4)17(20)7-6-15-13(11-18(22)23)10-14(25-3)12-16(15)20/h10,12,17H,5-9,11H2,1-4H3,(H,22,23)/t17?,20-,21?/m1/s1 |
| InChIKey |
QPXAJFOKMSXMDQ-TWMPVWRBSA-N |
| Molecular Weight |
360.450 g/mol |
| SMILES |
OC(Cc1c2c([C@@]3(C(C(C(=O)OC)(C)CCC3)CC2)C)cc(OC)c1)=O |
| SPLASH |
splash10-03dr-0059000000-33af494cc6dc503fcff4 |
| Source of Spectrum |
F-56-4013-48 |
| Wiley ID |
857299 |
![2-[14-(Methyl 12-methoxy-7-oxopodocarpa-8,11,13-trien-19-oate)]ethanoic acid](/api/spectrum/iSwIuQas2H/structure.png?h=300&w=458 "2-[14-(Methyl 12-methoxy-7-oxopodocarpa-8,11,13-trien-19-oate)]ethanoic acid")
