Feedback
Estrone-3,4-quinone
MNXM52647 is deprecated and here replaced by MNXM737719
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM737719 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
5 |
|
| formula | C18H20O3 |
| charge | 0 |
| mass | 284.14124 |
| reference | biggM:CE5251 |
| InChIKey | REMSDZFYMQQJFD-PEDDLLMLSA-N |
| InChI | InChI=1S/C18H20O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14H,2-3,5,7-9H2,1H3/t11?,12?,14?,18-/m0/s1 |
| SMILES | C[C@]12CCC3C4=C(CCC3C1CCC2=O)C(=O)C(=O)C=C4 |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
Similar chemical compounds in external resources
| Identifier | Description |
|---|
bigg.metabolite:CE5251
biggM:CE5251
| Estrone-3,4-quinone
|
| hmdb:HMDB0012942
| Estrone-3,4-quinone
(15S)-15-methyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-2(7),3-diene-5,6,14-trione
Catecholestrogen quinone
|
hmdb:HMDB12942
biggM:M_CE5251
| secondary/obsolete/fantasy identifier
|
