SpectraBase Spectrum ID |
H4h4KyGoHoM |
Name |
2-Acetonyl-5-hydroxy-3-[3-keto-4-(2-methyl-1,3-dioxolan-2-yl)butyl]-1,4-naphthoquinone |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H22O7 |
InChI |
InChI=1S/C21H22O7/c1-12(22)10-16-14(7-6-13(23)11-21(2)27-8-9-28-21)20(26)18-15(19(16)25)4-3-5-17(18)24/h3-5,24H,6-11H2,1-2H3 |
InChIKey |
OHYFRSROIZZNAJ-UHFFFAOYSA-N |
Molecular Weight |
386.400 g/mol |
SMILES |
Oc1c2c(C(C(=C(C2=O)CCC(CC2(OCCO2)C)=O)CC(=O)C)=O)ccc1 |
SPLASH |
splash10-000i-9020000000-0877d9123b20ebd785cc |
Source of Spectrum |
J-62-2355-12 |
Synonyms |
2-Acetonyl-5-hydroxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxo-butyl]naphthalene-1,4-dione
3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxidanylidene-butyl]-5-oxidanyl-2-(2-oxidanylidenepropyl)naphthalene-1,4-dione
5-Hydroxy-3-[4-(2-methyl-1,3-dioxolan-2-yl)-3-oxobutyl]-2-(2-oxopropyl)naphthalene-1,4-dione |
Wiley ID |
1362618 |