EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:227005 - Altemicidin

ChEBI IDCHEBI:227005
ChEBI NameAltemicidin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H20N4O7S
Net Charge0
Average Mass376.391
Monoisotopic Mass376.10527
SMILESCN1C=C(C(N)=O)[C@@H]2C[C@H](O)[C@@](NC(=O)CS(N)(=O)=O)(C(=O)O)[C@@H]2C1
InChIInChI=1S/C13H20N4O7S/c1-17-3-7(11(14)20)6-2-9(18)13(12(21)22,8(6)4-17)16-10(19)5-25(15,23)24/h3,6,8-9,18H,2,4-5H2,1H3,(H2,14,20)(H,16,19)(H,21,22)(H2,15,23,24)/t6-,8+,9-,13+/m0/s1
InChIKeyVZRFZUPFQKSXPV-VPFIQFBESA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (2584138)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Altemicidin (CHEBI:227005) is a N-acyl-L-amino acid (CHEBI:21644)
Altemicidin (CHEBI:227005) is conjugate acid of altemicidin(1−) (CHEBI:232089)
Incoming Relation(s)
altemicidin(1−) (CHEBI:232089) is conjugate base of Altemicidin (CHEBI:227005)
IUPAC Name 
(4aR,6S,7R,7aS)-4-carbamoyl-6-hydroxy-2-methyl-7-[(2-sulamoylacetyl)amino]-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyridine-7-carboxylic acid
Manual XrefsDatabases
9211348ChemSpider