Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-14 23:11:52 UTC
Update Date2022-08-31 06:24:20 UTC
Metabolite IDMMDBc0005678
Metabolite Identification
Common NameLucidone A
Description(2S,5S,7R,11R,14S,15R)-14-acetyl-5-hydroxy-2,6,6,11,15-pentamethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(10)-ene-12,17-dione belongs to the class of organic compounds known as 20-oxosteroids. These are steroid derivatives carrying a C=O group at the 20-position of the steroid skeleton. Based on a literature review very few articles have been published on (2S,5S,7R,11R,14S,15R)-14-acetyl-5-hydroxy-2,6,6,11,15-pentamethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(10)-ene-12,17-dione.
Structure
SynonymsNot Available
Molecular FormulaC24H34O4
Average Mass386.532
Monoisotopic Mass386.245709575
IUPAC Name(2S,5S,7R,11R,14S,15R)-14-acetyl-5-hydroxy-2,6,6,11,15-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-ene-12,17-dione
Traditional Name(2S,5S,7R,11R,14S,15R)-14-acetyl-5-hydroxy-2,6,6,11,15-pentamethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-ene-12,17-dione
CAS Registry NumberNot Available
SMILES
[H][C@@]1(CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@]([H])(O)C(C)(C)[C@]1([H])CC3)C(C)=O
InChI Identifier
InChI=1S/C24H34O4/c1-13(25)15-11-19(28)24(6)14-7-8-17-21(2,3)18(27)9-10-22(17,4)20(14)16(26)12-23(15,24)5/h15,17-18,27H,7-12H2,1-6H3/t15-,17+,18+,22+,23-,24-/m1/s1
InChI KeyOPFVUKGFDOGFHA-WQULKZAJSA-N