EUD
Summary
Name: | EUDESMANE CATION |
Formula: | C15 H26 |
Formal charge: | 0 |
Formula weight: | 206.367 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (1R,4aR,7S,8aS)-1,4a-dimethyl-7-(1-methylethenyl)decahydronaphthalene |
OpenEye OEToolkits | 1.5.0 | (3S,4aS,8aR)-5,8a-dimethyl-3-prop-1-en-2-yl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | C=C(\C1CCC2(CCCC(C2C1)C)C)C |
SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H]1CCC[C@]2(C)CC[C@@H](C[C@@H]12)C(C)=C |
SMILES | CACTVS | 3.341 | C[CH]1CCC[C]2(C)CC[CH](C[CH]12)C(C)=C |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1CCC[C@]2([C@H]1C[C@H](CC2)C(=C)C)C |
SMILES | OpenEye OEToolkits | 1.5.0 | CC1CCCC2(C1CC(CC2)C(=C)C)C |
InChI | InChI | 1.03 | InChI=1S/C15H26/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h12-14H,1,5-10H2,2-4H3/t12-,13+,14+,15-/m1/s1 |
InChIKey | InChI | 1.03 | DJLBUNMUAZWONS-CBBWQLFWSA-N |