For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
9-O-Acetoxy-17,18-didehydro-11-O-(tetrahydropyran-2-yl)-PGF(3.alpha.) methyl ester
SpectraBase Compound ID 74ViJUjTEq7
InChI InChI=1S/C28H42O7/c1-4-5-8-13-22(30)17-18-24-23(14-9-6-7-10-15-27(31)32-3)25(34-21(2)29)20-26(24)35-28-16-11-12-19-33-28/h6,9,17-18,22-26,28,30H,4,7,10-16,19-20H2,1-3H3/b9-6-,18-17+/t22?,23-,24-,25+,26-,28?/m1/s1
InChIKey AGVCZKSCKWFZKY-DQTPNDNCSA-N
Mol Weight 490.6 g/mol
Molecular Formula C28H42O7
Exact Mass 490.293054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AeU8R0xR84H
Name 9-O-Acetoxy-17,18-didehydro-11-O-(tetrahydropyran-2-yl)-PGF(3.alpha.) methyl ester
Alternate Name(s) (5Z,9beta,11beta,13E)-15-hydroxy-1-methoxy-1-oxo-11-(tetrahydro-2H-pyran-2-yloxy)prosta-5,13-dien-17-yn-9-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H42O7
InChI InChI=1S/C28H42O7/c1-4-5-8-13-22(30)17-18-24-23(14-9-6-7-10-15-27(31)32-3)25(34-21(2)29)20-26(24)35-28-16-11-12-19-33-28/h6,9,17-18,22-26,28,30H,4,7,10-16,19-20H2,1-3H3/b9-6-,18-17+/t22?,23-,24-,25+,26-,28?/m1/s1
InChIKey AGVCZKSCKWFZKY-DQTPNDNCSA-N
Molecular Weight 490.637 g/mol
SMILES OC(\C=C\[C@]1([C@@](C[C@](OC(=O)C)([C@@]1(C\C=C/CCCC(=O)OC)[H])[H])(OC1OCCCC1)[H])[H])CC#CCC
SPLASH splash10-00b9-0009000000-54d37c3f7718c1f3c02b
Source of Spectrum F-48-1977-9
Wiley ID 1397268