Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, 2-(((4-(2-hydroxy-1-methylethyl)-1-methyl-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, (1alpha,2alpha,4alpha,4(R*))-
RN: 99827-44-8
InChIKey: YOGGXQIGRTZOQH-SIYGNZJNSA-N

Molecular Formula

  • C18-H24-O5

Molecular Weight

  • 320.383
 
* 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

Synonym

  • 2-(((1R,2S)-4-((2R)-1-Hydroxypropan-2-yl)-1-methyl-7-oxabicyclo(2.2.1)heptan-2-yl)oxymethyl)benzoic acid

Systematic Name

  • Benzoic acid, 2-(((4-(2-hydroxy-1-methylethyl)-1-methyl-7-oxabicyclo(2.2.1)hept-2-yl)oxy)methyl)-, (1alpha,2alpha,4alpha,4(R*))-

Registry Numbers

CAS Registry Number

  • 99827-44-8

System Generated Number

  • 0099827448

Structure Descriptors

InChI

1S/C18H24O5/c1-12(10-19)18-8-7-17(2,23-18)15(9-18)22-11-13-5-3-4-6-14(13)16(20)21/h3-6,12,15,19H,7-11H2,1-2H3,(H,20,21)/t12-,15+,17-,18?/m1/s1

InChIKey

YOGGXQIGRTZOQH-SIYGNZJNSA-N

Smiles

c1ccc(c(CO[C@H]2C[C@@]3(CC[C@@]2(C)O3)[C@@H](CO)C)c1)C(O)=O