#3;BENTHAMININ-2;4,11B-DIMETHYL-7-METHYLENE-1,2,3,4,4A,5,6,6A,7,11,11A,11B-DODECAHYDRO-10-OXA-CYCLOPENTAL-[B]-PHENANTHRENE-4-CARBOXYLIC-ACID-METHYESTER
Compound with spectra: 1 NMR
![#3;BENTHAMININ-2;4,11B-DIMETHYL-7-METHYLENE-1,2,3,4,4A,5,6,6A,7,11,11A,11B-DODECAHYDRO-10-OXA-CYCLOPENTAL-[B]-PHENANTHRENE-4-CARBOXYLIC-ACID-METHYESTER](/api/compound/2qAn2v8RdrI.png?ph=true&h=300&w=458 "#3;BENTHAMININ-2;4,11B-DIMETHYL-7-METHYLENE-1,2,3,4,4A,5,6,6A,7,11,11A,11B-DODECAHYDRO-10-OXA-CYCLOPENTAL-[B]-PHENANTHRENE-4-CARBOXYLIC-ACID-METHYESTER")
| SpectraBase Compound ID | 2qAn2v8RdrI |
|---|---|
| InChI | InChI=1S/C21H28O3/c1-13-14-6-7-18-20(2,9-5-10-21(18,3)19(22)23-4)16(14)12-17-15(13)8-11-24-17/h8,11,14,16,18H,1,5-7,9-10,12H2,2-4H3/t14-,16-,18+,20+,21-/m0/s1 |
| InChIKey | BITNDSYDSKLXKB-ZBWTVIFZSA-N |
| Mol Weight | 328.45 g/mol |
| Molecular Formula | C21H28O3 |
| Exact Mass | 328.203845 g/mol |
| Enantiomer InChIKey | BITNDSYDSKLXKB-BPHAVFFISA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
CORDYLANE_D;CASSA-12,14-(17),15-TRIEN-19-ALPHA-HYDROXY-18-BETA-OIC_ACID
METHYL-VINHATICOATE
DEOXYCAESALDEKARIN-C
Phenanthro[3,2-b]furan-4-carboxylic acid, 1,2,3,4,4a,5,6,6a,7,11,11a,11b-dodecahydro-4,7,11b-trimethyl-, methyl ester, (4S,4aR,6aS,7R,11aS,11bR)-
LAPACHOYL-17-BETA-DIHYDROJUNICEDRATE-METHYLESTER
4,7,11b-trimethyl-1,2,3,4,4a,5,6,6a,7,11,11a,11b-dodecahydrophenanthro[3,2-b]furan-4-carboxylic acid
VOUACAPENIC ACID
(+)-VOUACAPENIC-ACID
VINHATICOIC-ACID
(1-S,4A-R,5-S,6-S,8A-R)-5-[2'-(5'',8''-DIACETOXYNAPHTHALEN-2''-YL)-ETHYL]-1,4A-DIMETHYL-DECAHYDRONAPHTHALENE-1,6-DICARBOXYLIC-ACID-1-METHYLESTER
| Title | Journal or Book | Year |
|---|---|---|
| Antibacterial and antioxidant cassane diterpenoids from Caesalpinia benthamiana | Phytochemistry | 2007 |