|
|
|
|
ScientificNameLabel
|
|
|
|
|
|
More Details :
|
|
|
| Names & Synonyms: |
(3R,3aS,5aS,8aS)-3,5a,7-trimethyl-8-methylene-1,2,3,3a,4,5-hexahydrocyclopenta[h]pentalene , (3R,3aS,5aS,8aS)-3,5a,7-trimethyl-8-methylidene-1,2,3,3a,4,5-hexahydrocyclopenta[h]pentalene
|
| Smiles: |
C[C@@H]1CC[C@@]23[C@H]1CC[C@@]3(C)C=C(C2=C)C
|
| InChi : |
InChI=1S/C15H22/c1-10-5-8-15-12(3)11(2)9-14(15,4)7-6-13(10)15/h9-10,13H,3,5-8H2,1-2,4H3/t10-,13+,14+,15+/m1/s1
|
| InChi Key : |
InChIKey=WBXUOIDEYMLLNE-KJEVXHAQSA-N
|
| PubChem ID : |
10703305
|
|
|
|
| Rotatable bond count : |
0
|
Rule of five : |
1
|
| Hydrogen bond acceptor count : |
0
|
Ionization potential : |
8.879893
|
| Hydrogen bond donor count : |
0
|
Electric dipole moment : |
0.352
|
| XLogP : |
6.02
|
VDW volume : |
225.653935
|
| Molecular weight : |
202.172151
|
HOMO-LUMO gap : |
9.359000
|
|
|
|
| Herb list : |
|
| Refrences & Litretures: |
|
|
|
|
|
|
|