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CHEBI:214413 - Psuedodestruxin C

ChEBI IDCHEBI:214413
ChEBI NamePsuedodestruxin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H55N5O7
Net Charge0
Average Mass669.864
Monoisotopic Mass669.41015
SMILESCC(C)CC1OC(=O)CCNC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2[C@@H](C)CCN2C1=O
InChIInChI=1S/C36H55N5O7/c1-21(2)19-27-35(46)41-18-16-24(7)31(41)33(44)38-26(20-25-13-11-10-12-14-25)34(45)40(9)30(23(5)6)36(47)39(8)29(22(3)4)32(43)37-17-15-28(42)48-27/h10-14,21-24,26-27,29-31H,15-20H2,1-9H3,(H,37,43)(H,38,44)/t24-,26-,27?,29-,30-,31-/m0/s1
InChIKeyLQGNIRWAURPTIG-FPKIXTKESA-N
Species of MetaboliteComponentSourceComments
Beauveria felina (ncbitaxon:37994) - PubMed (17136888)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Psuedodestruxin C (CHEBI:214413) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(10S,13S,16S,19S,20S)-16-benzyl-11,14,20-trimethyl-3-(2-methylpropyl)-10,13-di(propan-2-yl)-4-oxa-1,8,11,14,17-pentazabicyclo[17.3.0]docosane-2,5,9,12,15,18-hexone
Manual XrefsDatabases
10481538ChemSpider