(9α,11α,13E,15S)-9,11,15-Trihydroxy-6-oxoprost-13-en-1-oic-3,3,4,4-d4 acid

CAS Registry Number®

82414-64-0
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CAS Name

(9α,11α,13E,15S)-9,11,15-Trihydroxy-6-oxoprost-13-en-1-oic-3,3,4,4-d4 acid

Molecular Formula

C20H30D4O6

Cite this Page

(9α,11α,13E,15S)-9,11,15-Trihydroxy-6-oxoprost-13-en-1-oic-3,3,4,4-d4 acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=82414-64-0 (retrieved 2024-08-19) (CAS RN: 82414-64-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H34O6/c1-2-3-4-7-14(21)10-11-16-17(19(24)13-18(16)23)12-15(22)8-5-6-9-20(25)26/h10-11,14,16-19,21,23-24H,2-9,12-13H2,1H3,(H,25,26)/b11-10+/t14-,16+,17+,18+,19-/m0/s1/i5D2,6D2

InChIKey

InChIKey=KFGOFTHODYBSGM-GKZGVFJGSA-N

SMILES

C(C(CC(C(CC(O)=O)([2H])[2H])([2H])[2H])=O)[C@@H]1[C@@H](/C=C/[C@H](CCCCC)O)[C@H](O)C[C@@H]1O

Canonical SMILES

O=C(O)CCCCC(=O)CC1C(O)CC(O)C1C=CC(O)CCCCC

Other Names for this Substance

  • Prost-13-en-1-oic-3,3,4,4-d4 acid, 9,11,15-trihydroxy-6-oxo-, (9α,11α,13E,15S)-
  • (9α,11α,13E,15S)-9,11,15-Trihydroxy-6-oxoprost-13-en-1-oic-3,3,4,4-d4 acid