pretenellin B

Chemical Formula:

C₂₁H₂₂NO₄

Molecular Weight:

352.409 Daltons

Monoisotopic Mass:

353.1627082319 Daltons

SMILES:

CCC(C=C(C=CC(=O)C1(C(=O)NC=C(C([O-])=1)C2(C=CC(O)=CC=2)))C)C

InChI:

1S/C21H23NO4/c1-4-13(2)11-14(3)5-10-18(24)19-20(25)17(12-22-21(19)26)15-6-8-16(23)9-7-15/h5-13,23H,4H2,1-3H3,(H2,22,25,26)/p-1/b10-5+,14-11+

InChIKey:

RUYOCRHCIKMVOH-QDPFKYGGSA-M

Synonyms

3-[(2E,4E)-4,6-dimethyl-2,4-octadienoyl]-4-hydroxy-5-(4-hydroxyphenyl)-2(1H)-pyridinone

Databases

MetaCyc: CPD-17123

PubChem (CID): 91819830

ChemSpider: 28288695

MetaNetX: MNXM148471