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CHEBI:206342 - Leptolyngbyolide D

ChEBI IDCHEBI:206342
ChEBI NameLeptolyngbyolide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H70O11
Net Charge0
Average Mass739.000
Monoisotopic Mass738.49181
SMILESCO[C@H]1C[C@H](CC[C@H](C)[C@H](O)[C@H](C)[C@H]2OC(=O)/C=C/C(C)=C/C[C@H](O)C[C@@H]3C=CC[C@@H](C[C@H](OC)[C@@H](CO)[C@@H](OC)C[C@@H](OC)[C@@H]2C)O3)O[C@@H](C)C1
InChIInChI=1S/C41H70O11/c1-25-13-16-30(43)20-31-11-10-12-32(51-31)22-37(48-8)35(24-42)38(49-9)23-36(47-7)28(4)41(52-39(44)18-14-25)29(5)40(45)26(2)15-17-33-21-34(46-6)19-27(3)50-33/h10-11,13-14,18,26-38,40-43,45H,12,15-17,19-24H2,1-9H3/b18-14+,25-13+/t26-,27-,28-,29-,30-,31-,32-,33-,34+,35+,36+,37-,38-,40-,41-/m0/s1
InChIKeyWLCGOUZSQSIKDE-VIRRSBRTSA-N
Species of MetaboliteComponentSourceComments
Leptolyngbyaspecies (ncbitaxon:47254) - PubMed (28422340)
ChEBI Ontology
Outgoing Relation(s)
Leptolyngbyolide D (CHEBI:206342) is a macrolide (CHEBI:25106)
IUPAC Name 
(1R,3S,5E,7E,11R,12S,13R,15S,16R,17S,19S)-3-hydroxy-11-[(2S,3S,4S)-3-hydroxy-6-[(2S,4R,6S)-4-methoxy-6-methyloxan-2-yl]-4-methylhexan-2-yl]-16-(hydroxymethyl)-13,15,17-trimethoxy-6,12-dimethyl-10,23-dioxabicyclo[17.3.1]tricosa-5,7,21-trien-9-one
Manual XrefsDatabases
61708740ChemSpider