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Ptychantin L
SpectraBase Compound ID JAAeTXFlaCB
InChI InChI=1S/C26H42O7/c1-9-24(7,30)22(32-18(3)28)15-21-25(8,33-19(4)29)14-11-20-23(5,6)12-10-13-26(20,21)16-31-17(2)27/h9,20-22,30H,1,10-16H2,2-8H3/t20-,21-,22+,24?,25+,26+/m0/s1
InChIKey DAHUQEGQJYTVCS-NBKZVKIVSA-N
Mol Weight 466.6 g/mol
Molecular Formula C26H42O7
Exact Mass 466.293054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IX9InJAALT0
Name Ptychantin L
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H42O7
InChI InChI=1S/C26H42O7/c1-9-24(7,30)22(32-18(3)28)15-21-25(8,33-19(4)29)14-11-20-23(5,6)12-10-13-26(20,21)16-31-17(2)27/h9,20-22,30H,1,10-16H2,2-8H3/t20-,21-,22+,24?,25+,26+/m0/s1
InChIKey DAHUQEGQJYTVCS-NBKZVKIVSA-N
Literature Reference DOI 10.1002/jccs.200100039
Molecular Weight 466.615 g/mol
SMILES OC(C)([C@@](C[C@@]1([C@@]2(COC(C)=O)CCCC(C)([C@]2([H])CC[C@]1(OC(=O)C)C)C)[H])(OC(C)=O)[H])C=C
SPLASH splash10-0ac1-5930000000-02bc5ea457d6d36e4b23
Source of Spectrum QA-48-246-10
Synonyms (1R,2R,4aS,8aR)-1-((2R)-2-acetoxy-3-hydroxy-3-methylpent-4-en-1-yl)-8a-(acetoxymethyl)-2,5,5-trimethyldecahydronaphthalen-2-yl acetate
Wiley ID 1795331