| SpectraBase Spectrum ID |
51RkSohiT2 |
| Name |
2-[(6aR,9R,10aR)-6a,7,8,9,10,10a-Hexahydro-1,9-dihydroxy-6,6-dimethyl-6H-benzo[c]chromen-3-yl]-2-methylpropanoic Acid |
| Appearance |
Light yellow gum |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H26O5 |
| InChI |
InChI=1S/C19H26O5/c1-18(2,17(22)23)10-7-14(21)16-12-9-11(20)5-6-13(12)19(3,4)24-15(16)8-10/h7-8,11-13,20-21H,5-6,9H2,1-4H3,(H,22,23)/t11-,12-,13-/m1/s1 |
| InChIKey |
HAHQDEMAJARYLR-JHJVBQTASA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jmedchem.6b00717 |
| SMILES |
OC(C(c1cc2OC([C@@]3(CC[C@](C[C@]3(c2c(c1)O)[H])(O)[H])[H])(C)C)(C)C)=O |
| SPLASH |
splash10-001i-0398000000-a7481b0e236e9ae23c7b |
| Source of Spectrum |
AF-59-6912-4c |
| Wiley ID |
1848866 |
![2-[(6aR,9R,10aR)-6a,7,8,9,10,10a-Hexahydro-1,9-dihydroxy-6,6-dimethyl-6H-benzo[c]chromen-3-yl]-2-methylpropanoic Acid](/api/spectrum/51RkSohiT2/structure.png?h=300&w=458 "2-[(6aR,9R,10aR)-6a,7,8,9,10,10a-Hexahydro-1,9-dihydroxy-6,6-dimethyl-6H-benzo[c]chromen-3-yl]-2-methylpropanoic Acid")
