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sclarene
MNXM21700 is deprecated and here replaced by MNXM732555
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM732555 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
| formula | C20H32 |
| charge | 0 |
| mass | 272.2504 |
| reference | chebi:64281 |
| InChIKey | KYLKKZSVPLUGCC-CMKODMSKSA-N |
| InChI | InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m0/s1 |
| SMILES | C=CC(=C)CC[C@H]1C(=C)CC[C@H]2C(C)(C)CCC[C@]12C |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
Similar chemical compounds in external resources
| Identifier | Description |
|---|
CHEBI:64281
chebi:64281
| sclarene
(+)-sclarene
(4aS,5S,8aS)-1,1,4a-trimethyl-6-methylene-5-(3-methylenepent-4-en-1-yl)decahydronaphthalene
Delta(8,17.13,16.14)-labdatriene
labda-8(17),13(16),14-triene
|
