SCOPARIC-ACID-A;6-BENZOYL-12-HYDROXY-LABDA-8(17),13-DIEN-18-OIC-ACID
Compound with free spectra: 1 NMR, and 1 MS
| SpectraBase Compound ID | GaDb3C4z2LO |
|---|---|
| InChI | InChI=1S/C27H36O5/c1-18(13-16-28)11-12-21-19(2)17-22(32-24(29)20-9-6-5-7-10-20)23-26(21,3)14-8-15-27(23,4)25(30)31/h5-7,9-10,13,21-23,28H,2,8,11-12,14-17H2,1,3-4H3,(H,30,31)/b18-13+/t21-,22-,23?,26-,27-/m1/s1 |
| InChIKey | GIQOHSBJFWWSAH-XBKWZMHJSA-N |
| Mol Weight | 440.6 g/mol |
| Molecular Formula | C27H36O5 |
| Exact Mass | 440.256275 g/mol |
| Enantiomer InChIKey | GIQOHSBJFWWSAH-BENQWKSTSA-N |
| Copyright | Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | X2-55-1753-1 |
| Copyright | Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
- Scoparic acid A
SCOPARIC-ACID-A-MONOACETATE;6-BENZOYL-12-METHYLOXYCARBONYL-LABDA-8(17),13-DIEN-18-OIC-ACID
SCOPARIC-ACID-B;6-BENZOYL-14,15-DINOR-13-OXO-8(17)-LABDAN-18-OIC-ACID
SCOPARIC-ACID-C;6-BENZOYL-15-NOR-14-OXO-8(17)-LABDAN-18-OIC-ACID
Scoparic acid C
1-Naphthalenecarboxylic acid, 8-(acetyloxy)decahydro-1,4a-dimethyl-6-methylene-5-(3-methyl-2,4-pent adienyl)-, methyl ester, [1S-[1.alpha.,4a.alpha.,5.alpha.(Z),8.beta.,8a.beta.]]-
(Z)-6.alpha.-Acetoxylabda-8(17),12,14-trien-19-oic-acid, methylester
(1-R,2-S,6-R,7-R)-8-[1-CARBOXY-13,14,15,16-TETRANORLABD-8-(17)-EN-12-YL]-4,10-DIOXATRICYCLO-[5.2.1.0-(2.6)]-DECANE-3,5-DIONE
(1-S,2-R,6-S,7-S)-8-[1-CARBOXY-13,14,15,16-TETRANORLABD-8-(17)-EN-12-YL]-4,10-DIOXATRICYCLO-[5.2.1.0-(2.6)]-DECANE-3,5-DIONE
6-BETA,18-DIACETOXYCASSAN-13,15-DIENE
| Title | Journal or Book | Year |
|---|---|---|
| Scoparic Acid A, a β-Glucuronidase Inhibitor from Scoparia dulcis | Journal of Natural Products | 1992 |