Structure Database (LMSD)
Common Name
Vitamin K2
Systematic Name
Synonyms
- Vitamin K2
- menaquinone-6
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
PFRQBZFETXBLTP-RCIYGOBDSA-N
InChi (Click to copy)
InChI=1S/C41H56O2/c1-30(2)16-11-17-31(3)18-12-19-32(4)20-13-21-33(5)22-14-23-34(6)24-15-25-35(7)28-29-37-36(8)40(42)38-26-9-10-27-39(38)41(37)43/h9-10,16,18,20,22,24,26-28H,11-15,17,19,21,23,25,29H2,1-8H3/b31-18+,32-20+,33-22+,34-24+,35-28+
SMILES (Click to copy)
C1(=O)C(C)=C(C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C)C(=O)C2C=CC=CC1=2
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Brassica oleracea
(#3712)
Magnoliopsida
(#3398)
Phylloquinone (vitamin K1) content of vegetables,
J Food Comp Anal, 2005
J Food Comp Anal, 2005
Homo sapiens
(#9606)
Mammalia
(#40674)
Measurement of vitamin K in human liver by gradient elution high-performance liquid chromatography using platinum-black catalyst reduction and fluorimetric detection.,
J Chromatogr, 1989
J Chromatogr, 1989
Pubmed ID:
2753953
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
43
Rings
2
Aromatic Rings
1
Rotatable Bonds
17
Van der Waals Molecular Volume
668.14
Topological Polar Surface Area
34.14
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
12.37
Molar Refractivity
186.81
Admin
Created at
-
Updated at
5th Apr 2022