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CHEBI:198425 - Sordarin D

ChEBI IDCHEBI:198425
ChEBI NameSordarin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H38O9
Net Charge0
Average Mass506.592
Monoisotopic Mass506.25158
SMILESCO[C@H]1[C@@H](O)[C@H](O)[C@H](OC[C@@]23C[C@@H]4[C@H](C)CC[C@H]4[C@@]4(C=O)C[C@@H]2C(=O)C(=C(C)C)[C@@]34C(=O)O)O[C@@H]1C
InChIInChI=1S/C27H38O9/c1-12(2)18-19(29)17-9-25(10-28)16-7-6-13(3)15(16)8-26(17,27(18,25)24(32)33)11-35-23-21(31)20(30)22(34-5)14(4)36-23/h10,13-17,20-23,30-31H,6-9,11H2,1-5H3,(H,32,33)/t13-,14-,15-,16-,17-,20+,21+,22-,23-,25+,26+,27+/m1/s1
InChIKeyNDEIUYRUUIQFMO-QLTKOINASA-N
Species of MetaboliteComponentSourceComments
Xylotumulus gibbisporus (ncbitaxon:561973) - PubMed (24597849)
ChEBI Ontology
Outgoing Relation(s)
Sordarin D (CHEBI:198425) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
(1R,2S,4R,5R,8R,9S,11S)-2-[[(2R,3S,4S,5S,6R)-3,4-dihydroxy-5-methoxy-6-methyloxan-2-yl]oxymethyl]-9-ormyl-5-methyl-12-oxo-13-propan-2-ylidenetetracyclo[7.4.0.02,11.04,8]tridecane-1-carboxylic acid
Manual XrefsDatabases
78440729ChemSpider