SpectraBase Spectrum ID |
8igr5jOZOSR |
Name |
26-Norcoprost-24-en-16,22-epoxy-3.alpha.-ol benzoate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
490.344695338 u |
Formula |
C33H46O3 |
InChI |
InChI=1S/C33H46O3/c1-5-6-12-28-21(2)30-29(36-28)20-27-25-14-13-23-19-24(35-31(34)22-10-8-7-9-11-22)15-17-32(23,3)26(25)16-18-33(27,30)4/h5-11,21,23-30H,12-20H2,1-4H3/b6-5- |
InChIKey |
WUTSRQPPRGJOQP-WAYWQWQTSA-N |
Molecular Weight |
490.728 g/mol |
SMILES |
C1(CCC2(C(C1)CCC1C2CCC2(C1CC1C2C(C)C(C\C=C/C)O1)C)C)OC(C1=CC=CC=C1)=O |