| SpectraBase Spectrum ID |
64YdFVMvCYw |
| Name |
2-[(6aR,9S,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+/m0/s1 |
| InChIKey |
HAHQDEMAJARYLR-YNEHKIRRSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jmedchem.6b00717 |
| Molecular Weight |
334.412 g/mol |
| SMILES |
O[C@]1(CC[C@@]2([C@](c3c(cc(cc3O)C(C(O)=O)(C)C)OC2(C)C)(C1)[H])[H])[H] |
| SPLASH |
splash10-000t-0955000000-70b48458aad37e4b0b35 |
| Source of Spectrum |
AF-59-6912-4d |
| Wiley ID |
1848867 |
![2-[(6aR,9S,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/64YdFVMvCYw/structure.png?h=300&w=458 "2-[(6aR,9S,10aR)-6a,7,8,9,10,10a-Hexahydro-1,9-dihydroxy-6,6-dimethyl-6H-benzo[c]chromen-3-yl]-2-methylpropanoic Acid")
