EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:142062 - O3-[S-(3-{(1R,2S,6S,8R)-2,8-dimethyl-3-[(E)-prop-1-enyl]-4,5-didehydrodecalin-2-yl}-3-oxopropanoyl)pantetheine-4'-phosphoryl]-L-serine(1−) residue

Default Structure
ChEBI IDCHEBI:142062
ChEBI NameO3-[S-(3-{(1R,2S,6S,8R)-2,8-dimethyl-3-[(E)-prop-1-enyl]-4,5-didehydrodecalin-2-yl}-3-oxopropanoyl)pantetheine-4'-phosphoryl]-L-serine(1−) residue
Stars
ASCII NameO(3)-[S-(3-{(1R,2S,6S,8R)-2,8-dimethyl-3-[(E)-prop-1-enyl]-4,5-didehydrodecalin-2-yl}-3-oxopropanoyl)pantetheine-4'-phosphoryl]-L-serine(1-) residue
DefinitionAn O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1−) residue that has 3-{(1S,2R,4aS,6R,8aR)-1,6-dimethyl-2-[(1E)-prop-1-en-1-yl]-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl}-3-oxopropanoyl as the 3-oxoacyl group.
Last Modified3 September 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC32H49N3O10PS
Net Charge-1
Average Mass698.796
Monoisotopic Mass698.28818
SMILES*N[C@@H](COP(=O)([O-])OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)[C@]1(C)[C@H](/C=C/C)C=C[C@]2([H])C[C@H](C)CC[C@]21[H])C(*)=O
ChEBI Ontology
Outgoing Relation(s)
O3-[S-(3-{(1R,2S,6S,8R)-2,8-dimethyl-3-[(E)-prop-1-enyl]-4,5-didehydrodecalin-2-yl}-3-oxopropanoyl)pantetheine-4'-phosphoryl]-L-serine(1−) residue (CHEBI:142062) is a O-(S-3-oxoacylpantetheine-4'-phosphoryl)-L-serine(1−) residue (CHEBI:78776)
UniProt Name  Source
O3-[S-(3-{(1R,2S,6S,8R)-2,8-dimethyl-3-[(E)-prop-1-enyl]-4,5-didehydrodecalin-2-yl}-3-oxopropanoyl)pantetheine-4'-phosphoryl]-L-serine residueUniProt
Manual XrefsDatabases
CPD-17994MetaCyc
Citations