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CHEBI:22024 - S-12-hydroxyfarnesyl-L-cysteine

ChEBI IDCHEBI:22024
ChEBI NameS-12-hydroxyfarnesyl-L-cysteine
Stars
ASCII NameS-12-hydroxyfarnesyl-L-cysteine
DefinitionAn L-cysteine thioether that is S-(2E,6E)-farnesyl-L-cysteine bearing a hydroxy substituent on the pro-Z-methyl group at the 12-position.
Last Modified20 November 2014
DownloadsMolfile
FormulaC18H31NO3S
Net Charge0
Average Mass341.517
Monoisotopic Mass341.20246
SMILESC/C(=C/CC/C(C)=C/CC/C(C)=C/CSC[C@H](N)C(=O)O)CO
InChIInChI=1S/C18H31NO3S/c1-14(7-5-9-16(3)12-20)6-4-8-15(2)10-11-23-13-17(19)18(21)22/h6,9-10,17,20H,4-5,7-8,11-13,19H2,1-3H3,(H,21,22)/b14-6+,15-10+,16-9-/t17-/m0/s1
InChIKeyBFUAGAALIMPCLW-IJXSMPQSSA-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-12-hydroxyfarnesyl-L-cysteine (CHEBI:22024) has functional parent S-farnesyl-L-cysteine (CHEBI:22043)
S-12-hydroxyfarnesyl-L-cysteine (CHEBI:22024) is a L-cysteine thioether (CHEBI:27532)
IUPAC Name 
S-[(2E,6E,10Z)-12-hydroxy-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]-L-cysteine
Synonyms  Source
S-(E,E,Z)-farnesyl-L-cysteineChEBI
S-(2E,6E,10Z)-farnesyl-L-cysteineChEBI
2-amino-3-(12-hydroxy-3,7,11-trimethyl-3,6,10-dodecatrienylthio)propanoic acidRESID
(R,E,E,Z)-2-amino-3-(12-hydroxy-3,7,11-trimethyl-3,6,10-dodecatrienylsulfanyl)propanoic acidRESID
Manual XrefsDatabases
AA0103RESID