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narbonolide

PropertiesImage
MNX_IDMNXM7588 Image of MNXM7588
referencechebi:29650
formulaC20H32O5
global charge0
mol weight352.471
InChIKeyYFFOFFWSBYZSOI-HQWJGCFGSA-N
InChIInChI=1S/C20H32O5/c1-7-17-11(2)8-9-16(21)12(3)10-13(4)18(22)14(5)19(23)15(6)20(24)25-17/h8-9,11-15,17-18,22H,7,10H2,1-6H3/b9-8+/t11-,12-,13+,14-,15-,17-,18+/m1/s1
SMILESCC[C@H]1OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](O)[C@@H](C)C[C@@H](C)C(=O)/C=C/[C@H]1C
MNX internals
InChI (mnx)InChI=1/C20H32O5/c1-7-17-11(2)8-9-16(21)12(3)10-13(4)18(22)14(5)19(23)15(6)20(24)25-17/h8-9,11-15,17-18,22H,7,10H2,1-6H3/b9-8+/t11-,12-,13+,14-,15-,17-,18+/m1/s1 Image of MNXM7588
SMILES (mnx)[CH3:1][CH2:7][C@@H:17]1[C@H:11]([CH3:2])/[CH:8]=[CH:9]/[C:16](=[O:21])[C@H:12]([CH3:3])[CH2:10][C@H:13]([CH3:4])[C@H:18]([OH:22])[C@@H:14]([CH3:5])[C:19](=[O:23])[C@@H:15]([CH3:6])[C:20](=[O:24])[O:25]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:29650
chebi:29650
YFFOFFWSBYZSOI-HQWJGCFGSA-N 		narbonolide
(3R,5R,6S,7S,9R,11E,13R,14R)-14-ethyl-6-hydroxy-3,5,7,9,13-pentamethyloxacyclotetradec-11-ene-2,4,10-trione
Narbonolide

kegg.compound:C11997
keggC:C11997
vmhM:nrbld
vmhmetabolite:nrbld
YFFOFFWSBYZSOI-HQWJGCFGSA-N 		Narbonolide

seed.compound:cpd08794
seedM:cpd08794
YFFOFFWSBYZSOI-HQWJGCFGSA-N 		Narbonolide
narbonolide

metacyc.compound:CPD-15995
metacycM:CPD-15995
YFFOFFWSBYZSOI-HQWJGCFGSA-N 		narbonolide

keggC:M_C11997
seedM:M_cpd08794
vmhM:M_nrbld 		secondary/obsolete/fantasy identifier