Mycophenolic Acid

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Properties Simple | Detailed

Formula C17H20O6
IUPAC Name (e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid
Molecular Mass 320.337 g·mol−1
Heat of Formation -1043.8 ± 16.7 kJ·mol−1
Dipole Moment 5.17 ± 1.08 D
Volume 368.94 Å 3
Surface Area 305.3 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-4-hexenoic acid
  • (e)-6-(4-hydroxy-3-keto-6-methoxy-7-methyl-1h-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid
  • (e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid
  • (e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-4-methylhex-4-enoic acid
  • (e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid
  • (e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-isobenzofuran-5-yl)-4-methylhex-4-enoic acid
  • (e)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid
  • 4-hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5- isobenzofuranyl)-4-methyl-, (e)-
  • 4-hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (4e)- (9ci)
  • 4-hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (e)-
  • 4-hexenoic acid, 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4- methyl-, (e)-
  • 4-hexenoic acid, 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-, (e)-
  • 4-hexenoic acid, 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-, (e)- (8ci)
  • 4-methyl-5-methoxy-7-hydroxy-6-(5-carboxy-3-methylpent-2-en-1-yl)-phthalide (e)-
  • 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)- 4-methyl-4-hexenoic acid
  • 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methylhex-4-enoic acid
  • 6-(1,3-dihydro-7-hydroxy-5-methoxy-4-methyl-1-oxoisobenzofuran-6-yl)-4-methyl-4-hexanoic acid
  • 6-(4-hydroxy-3-keto-6-methoxy-7-methyl-1h-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid
  • 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid
  • 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-4-methylhex-4-enoic acid
  • 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid
  • 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1h-isobenzofuran-5-yl)-4-methylhex-4-enoic acid
  • 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid
  • 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-4-hexenoic acid (e)-
  • 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthanlanyl)-4-methyl-4-hexanoic acid
  • acon0_000960
  • acon1_000496
  • bpbio1_000695
  • d05096
  • lilly 68618
  • lilly-68618
  • ly 68618
  • megxm0_000120
  • melbex
  • micofenolico acido [spanish]
  • moa
  • mpa
  • mycophenolic acid (unspecified stereochemistry)
  • mycophenolic acid (usan)
  • mycophenolic acid, (e)-
  • mycophenolsaeure
  • myfortic
  • oprea1_330442
  • sdccgmls-0066618.p001
  • smp1_000202
  • tnp00198
  • tocris-1505
CAS Number(s)
  • 24280-93-1
  • 483-60-3
InChIKey HPNSFSBZBAHARI-RUDMXATFSA-N
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