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Methyl 13-[1'-((methoxycarbonyl)methyl)-2',2'-(ethylenedithio)propyl]podocarpa-8,11,13-trien-18-oate
SpectraBase Compound ID 3LKBV3aQKpK
InChI InChI=1S/C26H36O4S2/c1-24-11-6-12-25(2,23(28)30-5)21(24)10-8-17-15-18(7-9-19(17)24)20(16-22(27)29-4)26(3)31-13-14-32-26/h7,9,15,20-21H,6,8,10-14,16H2,1-5H3/t20?,21?,24-,25+/m1/s1
InChIKey OREVXFBJALKSBM-GBBDAIBUSA-N
Mol Weight 476.7 g/mol
Molecular Formula C26H36O4S2
Exact Mass 476.205502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Cp60PRfMNE
Name Methyl 13-[1'-((methoxycarbonyl)methyl)-2',2'-(ethylenedithio)propyl]podocarpa-8,11,13-trien-18-oate
CAS Registry Number 114958-35-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O4S2
InChI InChI=1S/C26H36O4S2/c1-24-11-6-12-25(2,23(28)30-5)21(24)10-8-17-15-18(7-9-19(17)24)20(16-22(27)29-4)26(3)31-13-14-32-26/h7,9,15,20-21H,6,8,10-14,16H2,1-5H3/t20?,21?,24-,25+/m1/s1
InChIKey OREVXFBJALKSBM-GBBDAIBUSA-N
Molecular Weight 476.690 g/mol
SMILES [C@@]12(C([C@](C(=O)OC)(C)CCC2)CCc2c1ccc(C(C1(SCCS1)C)CC(=O)OC)c2)C
SPLASH splash10-014i-0900000000-92c295540923d6d65a3b
Source of Spectrum J-53-3764-5
Wiley ID 1394301