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Chemical structure of Vitamin K1 2,3-epoxide

GC45148

Vitamin K1 2,3-epoxide

Also known as 7a-methyl-1a-(3,7,11,15-tetramethylhexadec-2-enyl)naphtho[2,3-b]oxirene-2,7-dione

Vitamin K is a dietary nutrient essential for the normal biosynthesis of factors that are required for blood clotting

ChemicalCAS25486-55-9MW466.7FormulaC31H46O3
CAS number
25486-55-9
Molecular weight
466.7
Formula
C31H46O3
Solubility
DMF: 25 mg/ml,DMSO: 25 mg/ml,Ethanol: 25 mg/ml
InChIKey
KUTXFBIHPWIDJQ-UHFFFAOYSA-N
Catalogue number
GC45148
Brand
GLPBIO
Computed properties PubChem CID 91577 · XLogP 10.1 · TPSA 46.7 Ų · H-bond donors 0
XLogP
10.1
TPSA
46.7 Ų
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
14
Heavy atoms
34

SMILES CC(C)CCCC(C)CCCC(C)CCCC(=CCC12C(=O)C3=CC=CC=C3C(=O)C1(O2)C)C

Computed descriptors from PubChem (CID 91577), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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