(3aS,4S,7aS)-Octahydro-7a-methyl-1,5-dioxo-1H-indene-4-propanoic acid

CAS Registry Number®

1944-63-4

CAS Name

(3aS,4S,7aS)-Octahydro-7a-methyl-1,5-dioxo-1H-indene-4-propanoic acid

Molecular Formula

C13H18O4

Molecular Mass

238.28

Cite this Page

(3aS,4S,7aS)-Octahydro-7a-methyl-1,5-dioxo-1H-indene-4-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1944-63-4 (retrieved 2024-11-21) (CAS RN: 1944-63-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H18O4/c1-13-7-6-10(14)8(2-5-12(16)17)9(13)3-4-11(13)15/h8-9H,2-7H2,1H3,(H,16,17)/t8-,9-,13-/m0/s1

InChIKey

InChIKey=PCCFNLPWOFTZPJ-RVBZMBCESA-N

SMILES

C[C@@]12[C@]([C@H](CCC(O)=O)C(=O)CC1)(CCC2=O)[H]

Canonical SMILES

O=C(O)CCC1C(=O)CCC2(C(=O)CCC12)C

Other Names for this Substance

  • 1H-Indene-4-propanoic acid, octahydro-7a-methyl-1,5-dioxo-, (3aS,4S,7aS)-
  • 4-Indanpropionic acid, 3aα,4β,5,6,7,7a-hexahydro-7aβ-methyl-1,5-dioxo-
  • 1H-Indene-4-propanoic acid, octahydro-7a-methyl-1,5-dioxo-, [3aS-(3aα,4α,7aβ)]-
  • (3aS,4S,7aS)-Octahydro-7a-methyl-1,5-dioxo-1H-indene-4-propanoic acid
  • 7aβ-Methylhexahydroindane-1,5-dione-4α-(3-propionic acid)

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Deleted or Replaced CAS Registry Numbers

13318-99-5, 67529-81-1

CAS INSIGHTSTM
Targeted protein degrader structure, illustration