Structure Database (LMSD)
Common Name
(-)-Ceriferol 1
Systematic Name
Synonyms
Main
Classification
Category
Main Class
Sub Class
Level 4 Class
String Representations
InChiKey (Click to copy)
AJSOCTGMVJYROT-NDACNNDESA-N
InChi (Click to copy)
InChI=1S/C25H40O/c1-20(2)9-6-13-23(5)25-17-15-22(4)11-7-10-21(3)12-8-14-24(19-26)16-18-25/h9,11-12,16,25-26H,5-8,10,13-15,17-19H2,1-4H3/b21-12-,22-11+,24-16-/t25-/m1/s1
SMILES (Click to copy)
C1=C(C)CCC=C(C)CC[C@@H](C(=C)CC/C=C(\C)/C)CC=C(CO)CC1
References
Calculated Physicochemical Properties
Heavy Atoms
26
Rings
1
Aromatic Rings
0
Rotatable Bonds
5
Van der Waals Molecular Volume
424.29
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
7.75
Molar Refractivity
116.79
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Created at
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Updated at
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