CHEBI:226645 - Phenalamide A3

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Phenalamide A3
ChEBI ID CHEBI:226645
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H45NO3
Net Charge 0
Average Mass 491.716
Monoisotopic Mass 491.33994
InChI InChI=1S/C32H45NO3/c1-24(15-11-8-7-9-12-16-26(3)32(36)33-29(6)23-34)21-27(4)31(35)28(5)22-25(2)19-20-30-17-13-10-14-18-30/h7-18,21-22,25,27,29,31,34-35H,19-20,23H2,1-6H3,(H,33,36)/b8-7+,12-9-,15-11+,24-21+,26-16+,28-22+/t25-,27+,29-,31+/m0/s1
InChIKey LCADVYTXPLBAGB-VQMVHRQNSA-N
SMILES O=C(N[C@H](CO)C)/C(=C/C=C\C=C\C=C\C(=C\[C@H]([C@@H](O)/C(=C/[C@H](CCC1=CC=CC=C1)C)/C)C)\C)/C
Metabolite of Species Details
Myxococcus (NCBI:txid32) See: PubMed
ChEBI Ontology
Outgoing Phenalamide A3 (CHEBI:226645) is a monoterpenoid (CHEBI:25409)
IUPAC Name
(2E,4Z,6E,8E,10E,12R,13R,14E,16S)-13-hydroxy-N-[(2S)-1-hydroxypropan-2-yl]-2,10,12,14,16-pentamethyl-18-phenyloctadeca-2,4,6,8,10,14-hexaenamide
Manual Xref Database
78442745 ChemSpider
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