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Methy 12-Benzoyloxy-6.alpha.,7.alpha.-epoxypodocarpa-8,11,13-trien-19-oate
SpectraBase Compound ID 2D4oX0yMdK3
InChI InChI=1S/C25H26O5/c1-24-12-7-13-25(2,23(27)28-3)21(24)20-19(30-20)17-11-10-16(14-18(17)24)29-22(26)15-8-5-4-6-9-15/h4-6,8-11,14,19-21H,7,12-13H2,1-3H3/t19-,20-,21?,24+,25+/m0/s1
InChIKey UMTLJVBUSTZXQF-QSVRTYMESA-N
Mol Weight 406.48 g/mol
Molecular Formula C25H26O5
Exact Mass 406.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9v29SB89Oe
Name Methy 12-Benzoyloxy-6.alpha.,7.alpha.-epoxypodocarpa-8,11,13-trien-19-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26O5
InChI InChI=1S/C25H26O5/c1-24-12-7-13-25(2,23(27)28-3)21(24)20-19(30-20)17-11-10-16(14-18(17)24)29-22(26)15-8-5-4-6-9-15/h4-6,8-11,14,19-21H,7,12-13H2,1-3H3/t19-,20-,21?,24+,25+/m0/s1
InChIKey UMTLJVBUSTZXQF-QSVRTYMESA-N
Molecular Weight 406.478 g/mol
SMILES [C@@]12([C@](c3ccc(OC(=O)c4ccccc4)cc3[C@@]3(C1[C@](C(=O)OC)(CCC3)C)C)(O2)[H])[H]
SPLASH splash10-0a4i-1900000000-c317b9a1ba0f3f242a52
Source of Spectrum B-44-1570-14
Synonyms Methyl (1aR,2R,5aS,9bS)-7-(benzoyloxy)-2,5a-dimethyl-1a,1b,2,3,4,5,5a,9b-octahydrophenanthro[9,10-b]oxirene-2-carboxylate
Wiley ID 1372323