CHEBI:204063 - Beauveriolide VII

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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 Beauveriolide VII
ChEBI ID CHEBI:204063
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H39N3O5
Net Charge 0
Average Mass 473.614
Monoisotopic Mass 473.28897
InChI InChI=1S/C26H39N3O5/c1-6-7-11-17(4)21-15-22(30)28-20(14-19-12-9-8-10-13-19)25(32)27-18(5)24(31)29-23(16(2)3)26(33)34-21/h8-10,12-13,16-18,20-21,23H,6-7,11,14-15H2,1-5H3,(H,27,32)(H,28,30)(H,29,31)/t17?,18-,20-,21?,23+/m0/s1
InChIKey OVLSBHCZQRFSPZ-VJZUKPHFSA-N
SMILES O=C1OC(C(CCCC)C)CC(=O)N[C@@H](CC2=CC=CC=C2)C(N[C@H](C(N[C@@H]1C(C)C)=O)C)=O
Metabolite of Species Details
Beauveria (NCBI:txid5581) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Beauveriolide VII (CHEBI:204063) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name
(3R,6S,9S)-9-benzyl-13-hexan-2-yl-6-methyl-3-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone
Manual Xref Database
8132126 ChemSpider
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