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Substance Name: 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic acid, o-methoxybenzyl ester, exo-(Z)-
RN: 30627-47-5
InChIKey: LCUIUKLEZMUNSQ-MRFVTOPCSA-N

Molecular Formula

  • C16-H18-O6

Molecular Weight

  • 306.312
 
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Names and Synonyms

Synonyms

  • BRN 3998170
  • exo-trans-7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic acid

Systematic Name

  • 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic acid, o-methoxybenzyl ester, exo-(Z)-

Registry Numbers

CAS Registry Number

  • 30627-47-5

System Generated Number

  • 0030627475

Structure Descriptors

InChI

1S/C16H18O6/c1-20-10-5-3-2-4-9(10)8-21-16(19)14-12-7-6-11(22-12)13(14)15(17)18/h2-5,11-14H,6-8H2,1H3,(H,17,18)/t11-,12+,13?,14?/m0/s1

InChIKey

LCUIUKLEZMUNSQ-MRFVTOPCSA-N

Smiles

C1[C@@H]2[C@@H]([C@@H]([C@@H](C1)O2)C(=O)OCc1c(cccc1)OC)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 30mg/kg (30mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 175, 1971.