vitamin K 2,3-epoxide

Chemical Formula:

C₃₁H₄₆O₃

Molecular Weight:

466.703 Daltons

Monoisotopic Mass:

466.34469534289997 Daltons

SMILES:

CC(C)CCCC(C)CCCC(C)CCCC(C)=CCC13(OC(C)(C(=O)C2(C=CC=CC(C(=O)1)=2))3)

InChI:

1S/C31H46O3/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-31-29(33)27-19-8-7-18-26(27)28(32)30(31,6)34-31/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-,30?,31?/m1/s1

InChIKey:

KUTXFBIHPWIDJQ-HBDFACPTSA-N

Synonyms

2,3-epoxyphylloquinone
2,3-epoxy-2,3-dihydro-2-methyl-3-phytyl-1,4-naphthoquinone

Databases

MetaCyc: 23-EPOXY-23-DIHYDRO-2-METHYL-14-NAPHTHOQ

ChEBI: 15759

PubChem (CID): 5460204

HMDB: HMDB02972

ChemSpider: 4444391

KEGG: C05849

RefMet: 2,3-Epoxyphylloquinone

MetaNetX: MNXM2912