resolvin E1

Chemical Formula:

C₂₀H₂₉O₅

Molecular Weight:

349.446 Daltons

Monoisotopic Mass:

350.2093240735 Daltons

SMILES:

CCC(O)C=CC=CCC(O)C=CC=CC=CC(O)CCCC(=O)[O-]

InChI:

1S/C20H30O5/c1-2-17(21)11-8-5-9-14-18(22)12-6-3-4-7-13-19(23)15-10-16-20(24)25/h3-9,11-13,17-19,21-23H,2,10,14-16H2,1H3,(H,24,25)/p-1/b4-3+,9-5-,11-8+,12-6+,13-7-/t17-,18+,19-/m1/s1

InChIKey:

AOPOCGPBAIARAV-OTBJXLELSA-M

Synonyms

5S,12R,18R-trihydroxy-6Z,8E,10E,14Z,16E-eicosapentaenoate

Databases

MetaCyc: CPD66-57

RefMet: Resolvin E1

ChEBI: 91000

PubChem (CID): 91820117 10473088

KEGG: C18171

Seed: cpd19441

HMDB: HMDB10410

MetaNetX: MNXM80716