Structure Database (LMSD)
Common Name
2R-methyl-hop-17(21)-ene
Systematic Name
2R-methyl-hop-17(21)-ene
Synonyms
- 2-methyl-hop-17(21)-ene
3D model of 2R-methyl-hop-17(21)-ene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
Taxonomy Information
String Representations
InChiKey (Click to copy)
ONQNHFFIXHEQPK-PGVSLFDPSA-N
InChi (Click to copy)
InChI=1S/C31H52/c1-20(2)22-12-15-28(6)23(22)13-16-30(8)25(28)10-11-26-29(7)19-21(3)18-27(4,5)24(29)14-17-31(26,30)9/h20-21,24-26H,10-19H2,1-9H3/t21-,24+,25-,26-,28+,29+,30-,31-/m1/s1
SMILES (Click to copy)
[C@]12([H])CC[C@]3([H])[C@@]4(C)CCC(C(C)C)=C4CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)C[C@@H](C)C[C@]21C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
31
Rings
5
Aromatic Rings
Rotatable Bonds
1
Van der Waals Molecular Volume
480.42
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
Hydrogen Bond Acceptors
logP
9.44
Molar Refractivity
133.88
Admin
Created at
23rd Aug 2022
Updated at
23rd Aug 2022