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calonectrin
MNXM120097 is deprecated and here replaced by MNXM727279
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM727279 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
| formula | C19H26O6 |
| charge | 0 |
| mass | 350.17294 |
| reference | chebi:157610 |
| InChIKey | IGDIDZAQDRAJRB-UPGMHYFXSA-N |
| InChI | InChI=1S/C19H26O6/c1-11-5-6-18(9-22-12(2)20)15(7-11)25-16-14(24-13(3)21)8-17(18,4)19(16)10-23-19/h7,14-16H,5-6,8-10H2,1-4H3/t14-,15-,16-,17-,18-,19+/m1/s1 |
| SMILES | CC(=O)OC[C@]12CCC(C)=C[C@H]1O[C@@H]1[C@H](OC(C)=O)C[C@@]2(C)[C@]12CO2 |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
Similar chemical compounds in external resources
| Identifier | Description |
|---|
CHEBI:157610
chebi:157610
| calonectrin
|
| hmdb:HMDB0034915
| Calonectrin
(+)-Calonectrin
(3-alpha)-12,13-Epoxytrichothec-9-ene-3,15-diol diacetate
10'-(acetyloxy)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-ylmethyl acetate
[10'-(Acetyloxy)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2'-yl]methyl acetic acid
|
| hmdb:HMDB34915
| secondary/obsolete/fantasy identifier
|
