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Chemical structure of cis-Vitamin K1

GC71857

cis-Vitamin K1

Also known as 2-methyl-3-[(Z,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione

Cis-Vitamin K1 is an endogenous metabolite of Vitamin K

ChemicalCAS16033-41-3MW450.7FormulaC31H46O2
CAS number
16033-41-3
Molecular weight
450.7
Formula
C31H46O2
InChIKey
MBWXNTAXLNYFJB-ODDKJFTJSA-N
Catalogue number
GC71857
Brand
GLPBIO
Computed properties PubChem CID 9846607 · XLogP 10.9 · TPSA 34.1 Ų · H-bond donors 0
XLogP
10.9
TPSA
34.1 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
14
Heavy atoms
33

SMILES CC1=C(C(=O)C2=CC=CC=C2C1=O)C/C=C(/C)\CCC[C@H](C)CCC[C@H](C)CCCC(C)C

Computed descriptors from PubChem (CID 9846607), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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