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CHEBI:188805 - Cruentaren A

ChEBI IDCHEBI:188805
ChEBI NameCruentaren A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H51NO8
Net Charge0
Average Mass589.770
Monoisotopic Mass589.36147
SMILESCCCC(O)C(C)C(=O)NC/C=C\CC(C)C(O)C(C)C1C/C=C\CC(C)C(O)Cc2cc(OC)cc(O)c2C(=O)O1
InChIInChI=1S/C33H51NO8/c1-7-12-26(35)22(4)32(39)34-16-11-10-14-21(3)31(38)23(5)29-15-9-8-13-20(2)27(36)18-24-17-25(41-6)19-28(37)30(24)33(40)42-29/h8-11,17,19-23,26-27,29,31,35-38H,7,12-16,18H2,1-6H3,(H,34,39)/b9-8-,11-10-
InChIKeyUXPPKIOUXFFKDI-XESWYYRISA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
Cruentaren A (CHEBI:188805) is a macrolide (CHEBI:25106)
IUPAC Name 
N-[(Z)-7-[(6Z)-10,16-dihydroxy-14-methoxy-9-methyl-2-oxo-3-oxabicyclo[10.4.0]hexadeca-1(12),6,13,15-tetraen-4-yl]-6-hydroxy-5-methyloct-2-enyl]-3-hydroxy-2-methylhexanamide
Manual XrefsDatabases
17250057ChemSpider