| SpectraBase Spectrum ID |
KDsmCvBD1su |
| Name |
2-[(1R,3S)-9-hydroxy-5,10-diketo-1-propyl-3,4-dihydro-1H-benz[g]isochromen-3-yl]acetic acid |
| CAS Registry Number |
73804-49-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18O6 |
| InChI |
InChI=1S/C18H18O6/c1-2-4-13-16-11(7-9(24-13)8-14(20)21)17(22)10-5-3-6-12(19)15(10)18(16)23/h3,5-6,9,13,19H,2,4,7-8H2,1H3,(H,20,21)/t9-,13+/m0/s1 |
| InChIKey |
XWXZEYLPRXYHQC-TVQRCGJNSA-N |
| Molecular Weight |
330.336 g/mol |
| SMILES |
Oc1c2c(C(C3=C([C@](O[C@](CC(=O)O)(C3)[H])(CCC)[H])C2=O)=O)ccc1 |
| SPLASH |
splash10-0036-0092000000-0c48346cec5b37191610 |
| Source of Spectrum |
J-51-358-5 |
| Synonyms |
2-[(1R,3S)-9-hydroxy-5,10-dioxo-1-propyl-3,4-dihydro-1H-benzo[g]isochromen-3-yl]acetic acid
2-[(1R,3S)-9-hydroxy-5,10-dioxo-1-propyl-3,4-dihydro-1H-benzo[g][2]benzopyran-3-yl]acetic acid
2-[(1R,3S)-9-oxidanyl-5,10-bis(oxidanylidene)-1-propyl-3,4-dihydro-1H-benzo[g]isochromen-3-yl]ethanoic acid |
| Wiley ID |
1327797 |
![2-[(1R,3S)-9-hydroxy-5,10-diketo-1-propyl-3,4-dihydro-1H-benz[g]isochromen-3-yl]acetic acid](/api/spectrum/KDsmCvBD1su/structure.png?h=300&w=458 "2-[(1R,3S)-9-hydroxy-5,10-diketo-1-propyl-3,4-dihydro-1H-benz[g]isochromen-3-yl]acetic acid")
