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Mycophenolic acid

CAS Registry Number®

24280-93-1

CAS Name

Mycophenolic acid

Molecular Formula

C17H20O6

Molecular Mass

320.34

Cite this Page

Mycophenolic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=24280-93-1 (retrieved 2024-11-22) (CAS RN: 24280-93-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    141 °C

  • Density (2)

    1.33 g/cm³

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+

InChIKey

InChIKey=HPNSFSBZBAHARI-RUDMXATFSA-N

SMILES

CC1=C2C(=C(O)C(C/C=C(/CCC(O)=O)\C)=C1OC)C(=O)OC2

Canonical SMILES

O=C1OCC2=C1C(O)=C(C(OC)=C2C)CC=C(C)CCC(=O)O

Other Names for this Substance

  • 4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (4E)-
  • 4-Hexenoic acid, 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)-4-methyl-, (E)-
  • 4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, (E)-
  • (4E)-6-(1,3-Dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-4-hexenoic acid
  • Mycophenolic acid

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CAS INSIGHTSTM
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