| SpectraBase Spectrum ID |
DngsiWZskeC |
| Name |
12a-hydroxyrotenone |
| Alternate Name(s) |
6ab,12ab-rotenolone
Rotenalone
Rotenolon I
Rotenolone
Rotenolone I
[1]benzopyrano[3,4-b]furo[2,3-h][1]benzopyran-6(6aH)-one, 1,2,12,12a-tetrahydro-6a-hydroxy-8,9-dimethoxy-2-(1-methylethenyl)-, (2R,6aR,12aR)- |
| CAS Registry Number |
509-96-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H22O7 |
| InChI |
InChI=1S/C23H22O7/c1-11(2)16-7-13-15(29-16)6-5-12-21(13)30-20-10-28-17-9-19(27-4)18(26-3)8-14(17)23(20,25)22(12)24/h5-6,8-9,16,20,25H,1,7,10H2,2-4H3/t16-,20-,23-/m1/s1 |
| InChIKey |
JFVKWCYZKMUTLH-AYPBNUJASA-N |
| Molecular Weight |
410.422 g/mol |
| SMILES |
O[C@]12c3c(cc(c(c3)OC)OC)OC[C@]1(Oc1c3c(O[C@](C3)(C(=C)C)[H])ccc1C2=O)[H] |
| SPLASH |
splash10-03di-0000900000-7d86a102fdefcce5f74c |
| Source of Spectrum |
KO-9-501-1 |
| Wiley ID |
1373650 |
