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CHEBI:62197 - S-[(2E,6E)-farnesyl]-L-cysteine

ChEBI IDCHEBI:62197
ChEBI NameS-[(2E,6E)-farnesyl]-L-cysteine
Stars
ASCII NameS-[(2E,6E)-farnesyl]-L-cysteine
DefinitionAn S-farnesyl-L-cysteine where the C=C double bonds at the 2- and 6-positions both have (E)-configuration.
Last Modified25 January 2022
SubmitterSteve
DownloadsMolfile
FormulaC18H31NO2S
Net Charge0
Average Mass325.518
Monoisotopic Mass325.20755
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CSC[C@H](N)C(=O)O
InChIInChI=1S/C18H31NO2S/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-22-13-17(19)18(20)21/h7,9,11,17H,5-6,8,10,12-13,19H2,1-4H3,(H,20,21)/b15-9+,16-11+/t17-/m0/s1
InChIKeySYSLNQMKLROGCL-BCYUYYMPSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
S-[(2E,6E)-farnesyl]-L-cysteine (CHEBI:62197) is a S-farnesyl-L-cysteine (CHEBI:22043)
S-[(2E,6E)-farnesyl]-L-cysteine (CHEBI:62197) is tautomer of S-[(2E,6E)-farnesyl]-L-cysteine zwitterion (CHEBI:62141)
Incoming Relation(s)
S-[(2E,6E)-farnesyl]-L-cysteine methyl ester (CHEBI:87167) has functional parent S-[(2E,6E)-farnesyl]-L-cysteine (CHEBI:62197)
S-[(2E,6E)-farnesyl]-L-cysteine residue (CHEBI:86019) is substituent group from S-[(2E,6E)-farnesyl]-L-cysteine (CHEBI:62197)
S-[(2E,6E)-farnesyl]-L-cysteino group (CHEBI:90595) is substituent group from S-[(2E,6E)-farnesyl]-L-cysteine (CHEBI:62197)
S-[(2E,6E)-farnesyl]-L-cysteine zwitterion (CHEBI:62141) is tautomer of S-[(2E,6E)-farnesyl]-L-cysteine (CHEBI:62197)
IUPAC Name 
S-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-L-cysteine
Synonyms  Source
S-(2-trans,6-trans)-farnesyl-L-cysteineChEBI
S-(trans,trans)-farnesyl-L-cysteineChEBI
S-farnesylcysteineChemIDplus
S-trans,trans-farnesylcysteineMetaCyc
S-all-trans-farnesylcysteineMetaCyc
2-trans-6-trans-farnesylcysteineMetaCyc
Manual XrefsDatabases
CPD-12581MetaCyc
Registry NumbersSources
Reaxys:2656458Reaxys
CAS:68000-92-0ChemIDplus
Citations