| SpectraBase Spectrum ID |
HzCRgf7oKI |
| Name |
1.beta.,7.beta., 16-Trihydroxy-dehydroabietic Acid |
| Alternate Name(s) |
(1R,4R,4aS,9S,10aR)-4,9-dihydroxy-7-(1-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid
(1R,4R,4aS,9S,10aR)-1,4a-dimethyl-4,9-bis(oxidanyl)-7-(1-oxidanylpropan-2-yl)-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H28O5 |
| InChI |
InChI=1S/C20H28O5/c1-11(10-21)12-4-5-14-13(8-12)15(22)9-16-19(2,18(24)25)7-6-17(23)20(14,16)3/h4-5,8,11,15-17,21-23H,6-7,9-10H2,1-3H3,(H,24,25)/t11?,15-,16-,17+,19+,20+/m0/s1 |
| InChIKey |
UDBCKSBBABXXHY-DTQSKRQLSA-N |
| Molecular Weight |
348.439 g/mol |
| SMILES |
OC([C@@]1(CC[C@]([C@]2([C@]1(C[C@@](c1c2ccc(c1)C(CO)C)(O)[H])[H])C)(O)[H])C)=O |
| SPLASH |
splash10-003r-0957000000-a2ab22024ffc9a789eea |
| Source of Spectrum |
G4-70-158-7 |
| Wiley ID |
1694904 |
