CHEBI:183527 - Glyuranolide

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Glyuranolide
ChEBI ID CHEBI:183527
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C31H44O6
Net Charge 0
Average Mass 512.687
Monoisotopic Mass 512.31379
InChI InChI=1S/C31H44O6/c1-26(2)20-8-11-30(6)23(29(20,5)10-9-21(26)33)19(32)14-17-18-15-27(3)16-22(37-24(27)34)28(18,4)12-13-31(17,30)25(35)36-7/h14,18,20-23,33H,8-13,15-16H2,1-7H3/t18-,20-,21-,22+,23+,27+,28+,29-,30+,31+/m0/s1
InChIKey MKDSBDQLSLPNOQ-YDJDNKAXSA-N
SMILES O1[C@]2([C@]3([C@](C=4[C@]([C@]5([C@@]([C@@]6([C@@](CC5)(C([C@@H](O)CC6)(C)C)[H])C)(C(=O)C4)[H])C)(CC3)C(OC)=O)(C[C@](C2)(C1=O)C)[H])C)[H]
Metabolite of Species Details
Ganoderma lucidum (NCBI:txid5315) Found in primordium (BTO:0001886). See: MetaboLights Study
Ganoderma lucidum (NCBI:txid5315) Found in fruit body (BTO:0000487). See: MetaboLights Study
ChEBI Ontology
Outgoing Glyuranolide (CHEBI:183527) is a triterpenoid (CHEBI:36615)
IUPAC Name
methyl (1R,2R,5R,6R,9R,11S,14S,15R,19S,21R)-11-hydroxy-2,6,10,10,14,21-hexamethyl-16,22-dioxo-23-oxahexacyclo[19.2.1.02,19.05,18.06,15.09,14]tetracos-17-ene-5-carboxylate
Manual Xref Database
169431 ChemSpider
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Registry Number Type Source
123914-44-3 CAS Registry Number ChemIDplus