CHEBI:206702 - Hydroxyldecandrin G

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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 Hydroxyldecandrin G
ChEBI ID CHEBI:206702
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H28O4
Net Charge 0
Average Mass 332.440
Monoisotopic Mass 332.19876
InChI InChI=1S/C20H28O4/c1-18(2)16-9-14(21)12-8-11(19(3,4)24)6-7-13(12)20(16,5)10-15(22)17(18)23/h6-8,15-17,22-24H,9-10H2,1-5H3/t15-,16+,17+,20-/m0/s1
InChIKey XHXDLQBMLSBHEF-XLSPSMHOSA-N
SMILES O=C1C2=C(C=CC(=C2)C(O)(C)C)[C@@]3(C[C@H](O)[C@H](C([C@H]3C1)(C)C)O)C
Metabolite of Species Details
Xylaria (NCBI:txid37991) See: PubMed
ChEBI Ontology
Outgoing Hydroxyldecandrin G (CHEBI:206702) is a diterpenoid (CHEBI:23849)
IUPAC Name
(2S,3S,4aR,10aS)-2,3-dihydroxy-7-(2-hydroxypropan-2-yl)-1,1,4a-trimethyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one