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CHEBI:138530 - ovothiol A disulfide

ChEBI IDCHEBI:138530
ChEBI Nameovothiol A disulfide
Stars
Last Modified27 September 2017
Submittermwilliams
DownloadsMolfile
FormulaC14H20N6O4S2
Net Charge0
Average Mass400.486
Monoisotopic Mass400.09875
SMILESCn1cnc(SSc2ncn(C)c2C[C@H](N)C(=O)O)c1C[C@H](N)C(=O)O
InChIInChI=1S/C14H20N6O4S2/c1-19-5-17-11(9(19)3-7(15)13(21)22)25-26-12-10(20(2)6-18-12)4-8(16)14(23)24/h5-8H,3-4,15-16H2,1-2H3,(H,21,22)(H,23,24)/t7-,8-/m0/s1
InChIKeyNRGVZXSKWPQYMK-YUMQZZPRSA-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)
ovothiol A disulfide (CHEBI:138530) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
ovothiol A disulfide (CHEBI:138530) is a organic disulfide (CHEBI:35489)
Manual XrefsDatabases
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