CHEBI:68238 - platensimycin B1

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ChEBI Name platensimycin B1
ChEBI ID CHEBI:68238
Definition A polycyclic cage that is the benzamide derivative of platensimycin. It is isolated from Streptomyces platensis.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C24H28N2O6
Net Charge 0
Average Mass 440.48890
Monoisotopic Mass 440.19474
InChI InChI=1S/C24H28N2O6/c1-22(7-6-17(29)26-18-14(27)4-3-13(19(18)30)21(25)31)16(28)5-8-24-10-12-9-15(20(22)24)32-23(12,2)11-24/h3-5,8,12,15,20,27,30H,6-7,9-11H2,1-2H3,(H2,25,31)(H,26,29)/t12-,15+,20+,22-,23+,24+/m1/s1
InChIKey KUDPXYYGDAJFNU-OFBLZTNGSA-N
SMILES [H][C@]12C[C@]3([H])O[C@@]1(C)C[C@@]1(C2)C=CC(=O)[C@@](C)(CCC(=O)Nc2c(O)ccc(C(N)=O)c2O)[C@]31[H]
Metabolite of Species Details
Streptomyces platensis (NCBI:txid58346) of strain MA7327 See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing platensimycin B1 (CHEBI:68238) has functional parent platensimycin (CHEBI:68236)
platensimycin B1 (CHEBI:68238) has role metabolite (CHEBI:25212)
platensimycin B1 (CHEBI:68238) is a benzamides (CHEBI:22702)
platensimycin B1 (CHEBI:68238) is a cyclic ether (CHEBI:37407)
platensimycin B1 (CHEBI:68238) is a cyclic ketone (CHEBI:3992)
platensimycin B1 (CHEBI:68238) is a polycyclic cage (CHEBI:33640)
platensimycin B1 (CHEBI:68238) is a resorcinols (CHEBI:33572)
IUPAC Name
3-({3-[(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]propanoyl}amino)-2,4-dihydroxybenzamide
Registry Number Type Source
19317592 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21214253 PubMed citation Europe PMC
Last Modified
06 September 2013