| 2D Structure | |
| CID | 94391 |
| Target | KARS1 , RXRA , RXRB , RXRG |
| IUPAC Name | (1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid |
| InChI | InChI=1S/C20H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h6,8,12-13,17H,5,7,9-11H2,1-4H3,(H,21,22)/t17-,19-,20-/m1/s1 |
| InChI Key | NFWKVWVWBFBAOV-MISYRCLQSA-N |
| Canonical SMILES | CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)O)C |
| Isomeric SMILES | CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)C(=O)O)C |
| Molecular Formula | C20H28O2 |
| Molecular Weight | 300.4 |
| synonyms | ['DEHYDROABIETIC ACID', 'Abieta-8,11,13-trien-18-oic acid', 'Abietic acid, dehydro-', '(-)-Dehydroabietic acid', '1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)-', '(+)-Dehydroabietic acid', 'NSC 2952', '13-Isopropylpodocarpa-8,11,13-trien-15-oic acid', 'CHEBI:29571', 'UNII-0S5XP6S3AU', 'EINECS 217-102-8', '0S5XP6S3AU', 'BRN 2059290', 'Podocarpa-8,11,13-trien-15-oic acid, 13-isopropyl-', 'NSC-2952', 'Isopropyl podocarpa-8,11,13-trien-15-oic acid', 'DTXSID8022163', '4-09-00-02389 (Beilstein Handbook Reference)', '1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R-(1alpha,4abeta,10aalpha))-', '(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid', '(1R-(1alpha,4Abeta,10aalpha))-1,2,3,4,4a,9,10,10a-octahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylic acid', '[1R-(1alpha,4abeta,10aalpha)]-1,2,3,4,4a,9,10,10a-octahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylic acid', '1,2,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic acid', '1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, [1R-(1.alpha.,4a.beta.,10a.alpha.)]-', '1,2,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic acid-, [1R-(1.alpha.,4a.beta.,10a.alpha.)]-', '(-)-Dehydroabietate', 'DTXCID402163', '13-Isopropylpodocarpa-8,11,13-trien-15-Oate', '1,2,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylate', '1,2,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic acid-, (1R-(1alpha,4abeta,10aalpha))-', 'inchi=1/c20h28o2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h6,8,12-13,17h,5,7,9-11h2,1-4h3,(h,21,22)/t17-,19-,20-/m1/s', 'nfwkvwvwbfbaov-ipnzsqqusa-n', 'nfwkvwvwbfbaov-lybxbrppsa-n', 'nfwkvwvwbfbaov-uhfffaoysa-n', '1740-19-8', 'Dehydroabietate', 'NSC2952', 'MFCD09839012', '6980-63-8', 'abieta-8(14),9(11),12-trien-18-oic acid', 'Dehydroabietlc acid', 'CHEMBL12850', 'SCHEMBL222078', 'Abieta-8,13-trien-18-oic acid', 'HY-N6869', 'MSK40116', '(+)-Dehydroabietic acid, tech grade', 'BDBM50143600', 'AKOS015917291', 'CS-W012130', 'FD20963', 'LMPR0104050005', '(1R,4aS,10aR)-1,2,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic Acid', '1ST40116', 'AC-34629', 'Dehydroabietic acid, >=95% (LC/MS-ELSD)', 'NS00010328', 'S3226', '13-Isopropylpodocarpa-8,13-trien-15-oic acid', 'EN300-6730478', 'Podocarpa-8,13-trien-15-oic acid, 13-isopropyl-', 'Q27110153', '5-Podocarpa-8,11,13-trien-15-oic acid, 13-isopropyl-', '(1R,4aS,10aR)-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid', '(1R-(1ALPHA,4ABETA,10AALPHA))-1,2,3,4,4A,9,10,10A-OCTAHYDRO- 7-ISOPROPYL-1,4A-DIMETHYLPHENANTHREN-1-CARBOXYLIC ACID', '1,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenecarboxylic acid', '1-PHENANTHRENECARBOXYLIC ACID, 1,2,3,4,4A,9,10,10A- OCTAHYDRO-1,4A-DIMETHYL-7-(1-METHYLETHYL)-, (1R,4AS,10AR)-', '1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, [1R-(1,4a,10a)]-', '1-Phenanthrenecarboxylic acid,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, [1R-(1.alpha.,4a.beta.,10a.alpha.)]-', 'rel-(1R,4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid', 'rel-(1R,4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylicacid'] |
From Pubchem