| SpectraBase Spectrum ID |
1JbstwbbZgX |
| Name |
4-Hydroxy-9,10-diketo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-anthracene-2-carboxylic acid |
| CAS Registry Number |
34298-86-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H18O11 |
| InChI |
InChI=1S/C21H18O11/c22-6-12-16(25)18(27)19(28)21(32-12)31-11-3-1-2-8-14(11)17(26)13-9(15(8)24)4-7(20(29)30)5-10(13)23/h1-5,12,16,18-19,21-23,25,27-28H,6H2,(H,29,30)/t12-,16-,18+,19-,21-/m1/s1 |
| InChIKey |
WYKUTTFFZMQCGO-HTRBZNBPSA-N |
| Molecular Weight |
446.364 g/mol |
| SMILES |
O[C@]1([C@@]([C@](O[C@]([C@@]1(O)[H])(Oc1c2C(c3c(C(c2ccc1)=O)cc(cc3O)C(=O)O)=O)[H])(CO)[H])(O)[H])[H] |
| SPLASH |
splash10-001i-0190000000-3763ab5093335bf79651 |
| Source of Spectrum |
KO-6-378-8 |
| Synonyms |
4-Hydroxy-9,10-dioxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-2-carboxylic acid
4-Hydroxy-9,10-dioxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-anthracene-2-carboxylic acid
4-Hydroxy-9,10-dioxo-5-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-anthracenecarboxylic acid
5-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-oxidanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid |
| Wiley ID |
1386501 |
