4-(Benzoylamino)phenyl (5Z,11α,13E,15S)-11,15-dihydroxy-9-oxoprosta-5,13-dien-1-oate

CAS Registry Number®

57790-53-1

CAS Name

4-(Benzoylamino)phenyl (5Z,11α,13E,15S)-11,15-dihydroxy-9-oxoprosta-5,13-dien-1-oate

Molecular Formula

C33H41NO6

Molecular Mass

547.68

Cite this Page

4-(Benzoylamino)phenyl (5Z,11α,13E,15S)-11,15-dihydroxy-9-oxoprosta-5,13-dien-1-oate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57790-53-1 (retrieved 2024-10-07) (CAS RN: 57790-53-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H41NO6/c1-2-3-7-14-26(35)19-22-29-28(30(36)23-31(29)37)15-10-4-5-11-16-32(38)40-27-20-17-25(18-21-27)34-33(39)24-12-8-6-9-13-24/h4,6,8-10,12-13,17-22,26,28-29,31,35,37H,2-3,5,7,11,14-16,23H2,1H3,(H,34,39)/b10-4-,22-19+/t26-,28+,29+,31+/m0/s1

InChIKey

InChIKey=PDKOSADNQUKMKP-QFPSZITRSA-N

SMILES

C(=C/[C@H](CCCCC)O)\[C@@H]1[C@@H](C/C=C\CCCC(OC2=CC=C(NC(=O)C3=CC=CC=C3)C=C2)=O)C(=O)C[C@H]1O

Canonical SMILES

O=C(OC1=CC=C(C=C1)NC(=O)C=2C=CC=CC2)CCCC=CCC3C(=O)CC(O)C3C=CC(O)CCCCC

Other Names for this Substance

  • Prosta-5,13-dien-1-oic acid, 11,15-dihydroxy-9-oxo-, 4-(benzoylamino)phenyl ester, (5Z,11α,13E,15S)-
  • 4-(Benzoylamino)phenyl (5Z,11α,13E,15S)-11,15-dihydroxy-9-oxoprosta-5,13-dien-1-oate

CAS INSIGHTSTM
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