vitamin K1-hydroperoxide - CAS 15576-39-3

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Catalog Number: M085725

CAS Number: 15576-39-3

PubChem Substance ID:355433476

Molecular Formula: C31H46O4

Molecular Weight:482.705

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

Synonymsvitamin K1-hydroperoxide

Property

Molecular Formula: C31H46O4
Molecular Weight482.705
Purity≥95%
Storage-20°C

Computed Descriptor

IUPAC Name2-[(E)-3-hydroperoxy-3,7,11,15-tetramethylhexadec-1-enyl]-3-methylnaphthalene-1,4-dione
InChIInChI=1S/C31H46O4/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-20-31(6,35-34)21-19-26-25(5)29(32)27-17-7-8-18-28(27)30(26)33/h7-8,17-19,21-24,34H,9-16,20H2,1-6H3/b21-19+
InChIKeyYUTUNMUCBDSKNC-XUTLUUPISA-N
SMILESCC1=C(C(=O)C2=CC=CC=C2C1=O)C=CC(C)(CCCC(C)CCCC(C)CCCC(C)C)OO