Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Thujaplicatin methyl ether
RN: 6512-67-0
UNII: 2VJD5SJF7V
InChIKey: XMLWGUKRPGLJGA-CABCVRRESA-N

Molecular Formula

  • C21-H24-O7

Molecular Weight

  • 388.414
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Thujaplicatin methyl ether

Synonym

  • UNII-2VJD5SJF7V

Systematic Name

  • 2(3H)-Furanone, dihydro-3-((4-hydroxy-3,5-dimethoxyphenyl)methyl)-4-((4-hydroxy-3-methoxyphenyl)methyl)-, (3S-trans)-

Registry Numbers

CAS Registry Number

  • 6512-67-0

FDA UNII

  • 2VJD5SJF7V

System Generated Number

  • 0006512670

Structure Descriptors

InChI

1S/C21H24O7/c1-25-17-8-12(4-5-16(17)22)6-14-11-28-21(24)15(14)7-13-9-18(26-2)20(23)19(10-13)27-3/h4-5,8-10,14-15,22-23H,6-7,11H2,1-3H3/t14-,15+/m1/s1

InChIKey

XMLWGUKRPGLJGA-CABCVRRESA-N

Smiles

O1C([C@H]([C@@H](C1)Cc1cc(c(cc1)O)OC)Cc1cc(c(c(c1)OC)O)OC)=O