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CHEBI:198833 - Vioprolide A

ChEBI IDCHEBI:198833
ChEBI NameVioprolide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H62N8O11S
Net Charge0
Average Mass863.048
Monoisotopic Mass862.42588
SMILESC/C=C1\NC(=O)C2CSC(=N2)C2CC(C)N2C(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(O)COC(=O)C(C(C)C)N(C)C(=O)C(C(C)O)NC(=O)C2CCCCN2C1=O
InChIInChI=1S/C40H62N8O11S/c1-10-24-37(55)47-14-12-11-13-27(47)34(53)45-30(23(8)49)39(57)46(9)31(20(4)5)40(58)59-17-29(50)35(54)41-22(7)32(51)43-25(15-19(2)3)38(56)48-21(6)16-28(48)36-44-26(18-60-36)33(52)42-24/h10,19-23,25-31,49-50H,11-18H2,1-9H3,(H,41,54)(H,42,52)(H,43,51)(H,45,53)/b24-10-
InChIKeyABYMZHOAONVEQS-VROXFSQNSA-N
Species of MetaboliteComponentSourceComments
Cystobacter (ncbitaxon:42) - DOI (10.1002/jlac.199619960617)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Vioprolide A (CHEBI:198833) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
(30Z)-30-ethylidene-13-hydroxy-20-(1-hydroxyethyl)-4,10,18-trimethyl-7-(2-methylpropyl)-17-propan-2-yl-15-oxa-35-thia-5,8,11,18,21,28,31,36-octazatetracyclo[31.2.1.02,5.023,28]hexatriacont-1(36)-ene-6,9,12,16,19,22,29,32-octone
Manual XrefsDatabases
78444759ChemSpider