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Estrone-2,3-quinone
MNXM52646 is deprecated and here replaced by MNXM737717
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM737717 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 3 |
| in models (compartimentalized) |
9 |
|
| formula | C18H20O3 |
| charge | 0 |
| mass | 284.14124 |
| reference | biggM:CE5252 |
| InChIKey | WFPLOQDPWXNOST-PEDDLLMLSA-N |
| InChI | InChI=1S/C18H20O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14H,2-7H2,1H3/t11?,12?,14?,18-/m0/s1 |
| SMILES | C[C@]12CCC3C4=CC(=O)C(=O)C=C4CCC3C1CCC2=O |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
Similar chemical compounds in external resources
| Identifier | Description |
|---|
bigg.metabolite:CE5252
biggM:CE5252
| Estrone-2,3-quinone
|
| hmdb:HMDB0012941
| Estrone-2,3-quinone
(15S)-15-methyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-2,6-diene-4,5,14-trione
Catecholestrogen quinone
|
hmdb:HMDB12941
biggM:M_CE5252
| secondary/obsolete/fantasy identifier
|
