CHEBI:225578 - Solitumidine B

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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 Solitumidine B
ChEBI ID CHEBI:225578
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H26N2O4
Net Charge 0
Average Mass 358.438
Monoisotopic Mass 358.18926
InChI InChI=1S/C20H26N2O4/c1-4-20(2,3)18-14(13-7-5-6-8-15(13)22-18)11-12-21-17(24)10-9-16(23)19(25)26/h4-8,16,22-23H,1,9-12H2,2-3H3,(H,21,24)(H,25,26)/t16-/m0/s1
InChIKey NXGGEMBPIKZQNL-INIZCTEOSA-N
SMILES O=C(O)[C@@H](O)CCC(=O)NCCC=1C2=C(C=CC=C2)NC1C(C=C)(C)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing Solitumidine B (CHEBI:225578) is a indoles (CHEBI:24828)
IUPAC Name
(2S)-2-hydroxy-5-[2-[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]ethylamino]-5-oxopentanoic acid
Manual Xref Database
81367085 ChemSpider
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