CHEBI:33999 - (1S)-Hydroxy-(2S)-N-acetyl-L-cysteinyl-1,2-dihydronaphthalene

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ChEBI Name (1S)-Hydroxy-(2S)-N-acetyl-L-cysteinyl-1,2-dihydronaphthalene
ChEBI ID CHEBI:33999
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C15H17NO4S
Net Charge 0
Average Mass 307.366
Monoisotopic Mass 307.08783
InChI InChI=1S/C15H17NO4S/c1-9(17)16-12(15(19)20)8-21-13-7-6-10-4-2-3-5-11(10)14(13)18/h2-7,12-14,18H,8H2,1H3,(H,16,17)(H,19,20)/t12-,13-,14-/m0/s1
InChIKey UPBOCTGEVBXZNT-IHRRRGAJSA-N
SMILES CC(=O)N[C@@H](CS[C@H]1C=Cc2ccccc2[C@@H]1O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing (1S)-Hydroxy-(2S)-N-acetyl-L-cysteinyl-1,2-dihydronaphthalene (CHEBI:33999) is a N-acyl-amino acid (CHEBI:51569)
(1S)-Hydroxy-(2S)-N-acetyl-L-cysteinyl-1,2-dihydronaphthalene (CHEBI:33999) is a acetamides (CHEBI:22160)
(1S)-Hydroxy-(2S)-N-acetyl-L-cysteinyl-1,2-dihydronaphthalene (CHEBI:33999) is a secondary carboxamide (CHEBI:140325)
Synonym Source
(1S)-Hydroxy-(2S)-N-acetyl-L-cysteinyl-1,2-dihydronaphthalene KEGG COMPOUND
Manual Xref Database
C14798 KEGG COMPOUND
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Last Modified
09 March 2018