CHEBI:204253 - Lajollamide A

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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 Lajollamide A
ChEBI ID CHEBI:204253
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C30H55N5O5
Net Charge 0
Average Mass 565.800
Monoisotopic Mass 565.42032
InChI InChI=1S/C30H55N5O5/c1-16(2)12-21-26(36)32-23(14-18(5)6)28(38)34-25(20(9)10)30(40)35(11)24(15-19(7)8)29(39)33-22(13-17(3)4)27(37)31-21/h16-25H,12-15H2,1-11H3,(H,31,37)(H,32,36)(H,33,39)(H,34,38)/t21-,22-,23-,24-,25-/m0/s1
InChIKey BXWBHHNYEHJKBE-KEOOTSPTSA-N
SMILES O=C1N([C@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H](C(N[C@H]1C(C)C)=O)CC(C)C)=O)CC(C)C)CC(C)C)CC(C)C)C
Metabolite of Species Details
Asteromyces cruciatus (NCBI:txid1407621) 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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Lajollamide A (CHEBI:204253) is a cyclic peptide (CHEBI:23449)
IUPAC Name
(3S,6S,9S,12S,15S)-1-methyl-6,9,12,15-tetrakis(2-methylpropyl)-3-propan-2-yl-1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone
Manual Xref Database
29215409 ChemSpider
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