CHEBI:2286 - 7a-Hydroxy-o-carbamoyl-deacetylcephalosporin C

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ChEBI Name 7a-Hydroxy-o-carbamoyl-deacetylcephalosporin C
ChEBI ID CHEBI:2286
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C15H20N4O9S
Net Charge 0
Average Mass 432.407
Monoisotopic Mass 432.09510
InChI InChI=1S/C15H20N4O9S/c16-7(10(21)22)2-1-3-8(20)18-15(27)12(25)19-9(11(23)24)6(4-28-14(17)26)5-29-13(15)19/h7,13,27H,1-5,16H2,(H2,17,26)(H,18,20)(H,21,22)(H,23,24)/t7-,13-,15+/m1/s1
InChIKey JMCGENBWRIPSAH-LNSLMCEBSA-N
SMILES N[C@H](CCCC(=O)N[C@@]1(O)[C@H]2SCC(COC(N)=O)=C(N2C1=O)C(O)=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 7a-Hydroxy-o-carbamoyl-deacetylcephalosporin C (CHEBI:2286) is a peptide (CHEBI:16670)
Synonym Source
7a-Hydroxy-o-carbamoyl-deacetylcephalosporin C KEGG COMPOUND
Manual Xref Database
C06569 KEGG COMPOUND
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Last Modified
28 July 2014