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CHEBI:68247 - homoplatensimide A

ChEBI IDCHEBI:68247
ChEBI Namehomoplatensimide A
Stars
DefinitionA polycyclic cage compound isolated from Streptomyces platensis.
Last Modified6 March 2014
DownloadsMolfile
FormulaC25H34N2O6
Net Charge0
Average Mass458.555
Monoisotopic Mass458.24169
SMILES[H][C@]12C[C@]34C=CC(=O)[C@@](C)(CC/C=C(\C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@]3([H])[C@]([H])(C1)O[C@@]2(C)C4
InChIInChI=1S/C25H34N2O6/c1-14(21(30)27-16(22(31)32)6-7-19(26)29)5-4-9-23(2)18(28)8-10-25-12-15-11-17(20(23)25)33-24(15,3)13-25/h5,8,10,15-17,20H,4,6-7,9,11-13H2,1-3H3,(H2,26,29)(H,27,30)(H,31,32)/b14-5+/t15-,16+,17+,20+,23-,24+,25+/m1/s1
InChIKeyLSLTZMQPHAAWAW-XJYCCHPDSA-N
Species of MetaboliteComponentSourceComments
Streptomyces platensis (ncbitaxon:58346) - PubMed (21214253) Strain: MA7327
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
homoplatensimide A (CHEBI:68247) has role bacterial metabolite (CHEBI:76969)
homoplatensimide A (CHEBI:68247) is a cyclic ether (CHEBI:37407)
homoplatensimide A (CHEBI:68247) is a cyclic ketone (CHEBI:3992)
homoplatensimide A (CHEBI:68247) is a dicarboxylic acid monoamide (CHEBI:35735)
homoplatensimide A (CHEBI:68247) is a monocarboxylic acid (CHEBI:25384)
homoplatensimide A (CHEBI:68247) is a polycyclic cage (CHEBI:33640)
Incoming Relation(s)
homoplatensimide A methyl ester (CHEBI:68248) has functional parent homoplatensimide A (CHEBI:68247)
IUPAC Name 
N2-{(2E)-5-[(1S,4aS,6S,7S,9S,9aR)-1,6-dimethyl-2-oxo-1,2,5,6,7,8,9,9a-octahydro-6,9-epoxy-4a,7-methanobenzo[7]annulen-1-yl]-2-methylpent-2-enoyl}-L-glutamine
Registry NumbersSources
Reaxys:15845102Reaxys
Citations