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Prost-13-en-1-oic acid, 9,11-bis(acetyloxy)-15-hydroxy-, methyl ester, (9.beta.,11.alpha.,13E,15S)-
SpectraBase Compound ID 8mjiLTtZuQr
InChI InChI=1S/C25H42O7/c1-5-6-9-12-20(28)15-16-22-21(13-10-7-8-11-14-25(29)30-4)23(31-18(2)26)17-24(22)32-19(3)27/h15-16,20-24,28H,5-14,17H2,1-4H3/b16-15+/t20-,21+,22+,23+,24+/m0/s1
InChIKey GEDJSMBBHJDJTK-CZUUIFAXSA-N
Mol Weight 454.6 g/mol
Molecular Formula C25H42O7
Exact Mass 454.293054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vGgLDXskc9
Name Prost-13-en-1-oic acid, 9,11-bis(acetyloxy)-15-hydroxy-, methyl ester, (9.beta.,11.alpha.,13E,15S)-
Alternate Name(s) (9alpha,11beta,13E,15S)-11-(acetyloxy)-15-hydroxy-1-methoxy-1-oxoprost-13-en-9-yl acetate 1-r-acetoxy-2-t(6'-methoxycarbonylhexyl)-3-c-(1'-n.octen-3'-ol)-4-t-acetoxy-cyclopentane
CAS Registry Number 61557-34-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H42O7
InChI InChI=1S/C25H42O7/c1-5-6-9-12-20(28)15-16-22-21(13-10-7-8-11-14-25(29)30-4)23(31-18(2)26)17-24(22)32-19(3)27/h15-16,20-24,28H,5-14,17H2,1-4H3/b16-15+/t20-,21+,22+,23+,24+/m0/s1
InChIKey GEDJSMBBHJDJTK-CZUUIFAXSA-N
Molecular Weight 454.604 g/mol
SMILES O[C@](\C=C\[C@]1([C@@](C[C@@](OC(=O)C)([C@@]1(CCCCCCC(=O)OC)[H])[H])(OC(=O)C)[H])[H])(CCCCC)[H]
SPLASH splash10-022i-0069000000-c4bb7765a594668b395e
Source of Spectrum AN-85-518-0
Wiley ID 1388777