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CHEBI:210276 - Asperterpene K

ChEBI IDCHEBI:210276
ChEBI NameAsperterpene K
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H38O8
Net Charge0
Average Mass490.593
Monoisotopic Mass490.25667
SMILESC=C1C[C@H]2[C@]3(C)CCC(=O)C(C)(C)[C@H]3C(=O)C[C@]2(C)[C@@H](C(=O)OC)[C@]1(C)C(=O)[C@](C)(O)C(=O)OC
InChIInChI=1S/C27H38O8/c1-14-12-16-24(4)11-10-17(29)23(2,3)18(24)15(28)13-25(16,5)19(20(30)34-8)26(14,6)21(31)27(7,33)22(32)35-9/h16,18-19,33H,1,10-13H2,2-9H3/t16-,18+,19+,24-,25-,26+,27-/m0/s1
InChIKeySRZXYFCAKRTTNY-JJAZPSFLSA-N
Species of MetaboliteComponentSourceComments
Aspergillus terreus (ncbitaxon:33178) - PubMed (30207465)
ChEBI Ontology
Outgoing Relation(s)
Asperterpene K (CHEBI:210276) is a oxo steroid (CHEBI:35789)
IUPAC Name 
methyl (1R,2S,4aS,4bS,8aS,10aS)-2-[(2S)-2-hydroxy-3-methoxy-2-methyl-3-oxopropanoyl]-2,4b,8,8,10a-pentamethyl-3-methylidene-7,9-dioxo-4,4a,5,6,8a,10-hexahydro-1H-phenanthrene-1-carboxylate
Manual XrefsDatabases
78439137ChemSpider