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Antrodioxolanone

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Antrodioxolanone
Names
Preferred IUPAC name (4R,5S)-4,5-Dimethyl-4,5-bis-1,3-dioxolan-2-one
Identifiers
CAS Number
3D model (JSmol)
ChEBI
ChEMBL
ChemSpider
PubChem CID
CompTox Dashboard (EPA)
InChI
  • InChI=1S/C29H32O9/c1-17-19(21(31-5)15-23(33-7)25(17)35-9)11-13-28(3)29(4,38-27(30)37-28)14-12-20-18(2)26(36-10)24(34-8)16-22(20)32-6/h15-16H,1-10H3/t28-,29+Key: NJECTZSLZHQUFD-ISILISOKSA-N
  • InChI=1/C29H32O9/c1-17-19(21(31-5)15-23(33-7)25(17)35-9)11-13-28(3)29(4,38-27(30)37-28)14-12-20-18(2)26(36-10)24(34-8)16-22(20)32-6/h15-16H,1-10H3/t28-,29+Key: NJECTZSLZHQUFD-ISILISOKBI
SMILES
  • CC1=C(C(=CC(=C1OC)OC)OC)C#C2((OC(=O)O2)(C)C#CC3=C(C(=C(C=C3OC)OC)OC)C)C
Properties
Chemical formula C29H32O9
Molar mass 524.566 g·mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Infobox references
Chemical compound

Antrodioxolanone is an anti-inflammatory alkyne isolated from Antrodia camphorata.

References

  1. "KNApSAcK Metabolite Information - C00038473". www.knapsackfamily.com.
  2. Chen, JJ; Lin, WJ; Liao, CH; Shieh, PC (2007). "Anti-inflammatory benzenoids from Antrodia camphorata". Journal of Natural Products. 70 (6): 989–92. doi:10.1021/np070045e. PMID 17559265.


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