(-)-Shikimic Acid

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Properties Simple | Detailed

Formula C7H10O5
IUPAC Name (3r,4s,5r)-3,4,5-trihydroxycyclohexene-1-carboxylic acid
Molecular Mass 174.151 g·mol−1
Heat of Formation -914.9 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 192.51 Å 3
Surface Area 184.76 Å 2
HOMO Energy -10.53 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid
  • (3r,4s,5r)-(−)-3,4,5-trihydroxy-1-cyclohexenecarboxylic acid
  • (3r,4s,5r)-(-)-3,4,5-trihydroxy-1-cyclohexenecarboxylic acid
  • (3r,4s,5r)-3,4,5-trihydroxy-1-cyclohexenecarboxylic acid
  • (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid
  • (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-enecarboxylic acid
  • (3r,4s,5r)-3,4,5-trihydroxycyclohexene-1-carboxylic acid
  • 1-cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3r,4s,5r)-
  • 1-cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3r,4s,5r)- (9ci)
  • 1-cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3r-(3alpha,4alpha,5beta))
  • 1-cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3r-(3alpha,4alpha,5beta))-
  • 1-cyclohexene-1-carboxylic acid, 3,4,5-trihydroxy-, (3r-(3alpha,4alpha,5beta))- (9ci)
  • 3,4,5-trihydroxy-1-cyclohexenecarboxylic acid
  • 3alpha,4alpha,5beta-trihydroxy-1-cyclohexene-1-carboxylic acid
  • [3r-(3alpha,4alpha,5beta)]-3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid
  • dhk
  • l-shikimic acid
  • megxp0_001939
  • s-5181
  • sdccgmls-0066740.p001
  • shikimic acid [3r-(3alpha,4alpha,5beta)]-3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid
  • skm
  • smp1_000326
  • sr-01000632403-1
InChIKey JXOHGGNKMLTUBP-HSUXUTPPSA-N
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