CHEBI:210945 - Platencin SL5

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ChEBI Name Platencin SL5
ChEBI ID CHEBI:210945
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H28O3
Net Charge 0
Average Mass 316.441
Monoisotopic Mass 316.20384
InChI InChI=1S/C20H28O3/c1-13(18(22)23)5-4-8-19(3)16-11-15-6-9-20(16,12-14(15)2)10-7-17(19)21/h7,10,13,15-16H,2,4-6,8-9,11-12H2,1,3H3,(H,22,23)/t13-,15-,16-,19-,20+/m0/s1
InChIKey OTSJYWFBWZYZTG-UTAYDHNUSA-N
SMILES O=C1C=C[C@]23CC(=C)[C@H](C[C@H]2[C@@]1(CCC[C@@H](C(=O)O)C)C)CC3
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Platencin SL5 (CHEBI:210945) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
(2S)-2-methyl-5-[(1S,5S,6R,8S)-5-methyl-9-methylidene-4-oxo-5-tricyclo[6.2.2.01,6]dodec-2-enyl]pentanoic acid