Structure Database (LMSD)
Common Name
C25:2 6,7-Epoxy highly branched isoprenoid
Systematic Name
2,6,14-trimethyl-6,7-epoxy-10-methylene-9-(3-methylpent-4-enyl)-pentadecane
Synonyms
3D model of C25:2 6,7-Epoxy highly branched isoprenoid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
YOCDPWQZFQLBCY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C25H46O/c1-9-21(6)15-16-23(22(7)14-10-12-19(2)3)18-24-25(8,26-24)17-11-13-20(4)5/h9,19-21,23-24H,1,7,10-18H2,2-6,8H3
SMILES (Click to copy)
CC(CCCC(=C)C(CCC(C)C=C)CC1OC1(CCCC(C)C)C)C
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
26
Rings
1
Aromatic Rings
0
Rotatable Bonds
15
Van der Waals Molecular Volume
432.21
Topological Polar Surface Area
12.53
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
logP
8.53
Molar Refractivity
117.52
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Created at
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Updated at
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