| SpectraBase Spectrum ID |
2W65oLvQ6a1 |
| Name |
2-Oxo-3-hydroxyestrogen-o-Quinone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22O4 |
| InChI |
InChI=1S/C18H22O4/c1-17-6-4-11-10(12(17)2-3-16(17)21)5-7-18(22)9-15(20)14(19)8-13(11)18/h8-12,20,22H,2-7H2,1H3/t10?,11?,12?,17?,18-/m1/s1 |
| InChIKey |
SGAATSHSKUXJER-MZIIBAJTSA-N |
| Molecular Weight |
302.370 g/mol |
| SMILES |
OC=1C(C=C2[C@](C1)(CCC1C2CCC2(C1CCC2=O)C)O)=O |
| SPLASH |
splash10-0f79-0955000000-8c150768883934541553 |
| Source of Spectrum |
CRT-9-862-6 |
| Wiley ID |
1709573 |
