
API0232356
Phytonadione
Phosphoric Acid is used as a pH adjuster and excipient.
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CAS No.
84-80-0
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Synonyms
VITAMIN K1; phytonadione; Phylloquinone
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CHEMBL ID
CHEMBL1550
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Indications
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Molecule Type
Small molecule
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Compound CID
5284607
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Molecular Weight (g/mol)
450.7
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Molecular Formula
C31H46O2
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InChI
InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1
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InChIKey
MBWXNTAXLNYFJB-NKFFZRIASA-N
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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
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IUPAC Name
2-methyl-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl]naphthalene-1,4-dione
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Exact Mass (Da)
450.349780706
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Monoisotopic Mass (Da)
450.349780706
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