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Strictaepoxide
SpectraBase Compound ID 6TmQERTdNIR
InChI InChI=1S/C28H40O5/c1-18(9-10-20-15-21(31-7)14-19(2)24(20)29)13-22-16-26(5)11-8-12-27(26,6)28(30,32-22)17-23-25(3,4)33-23/h9,14-16,23,29-30H,8,10-13,17H2,1-7H3/b18-9+/t23?,26-,27-,28-/m1/s1
InChIKey BXTGGRXRZJVAIL-PNNFBKSSSA-N
Mol Weight 456.6 g/mol
Molecular Formula C28H40O5
Exact Mass 456.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 561H8xf60jG
Name Strictaepoxide
CAS Registry Number 111488-06-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H40O5
InChI InChI=1S/C28H40O5/c1-18(9-10-20-15-21(31-7)14-19(2)24(20)29)13-22-16-26(5)11-8-12-27(26,6)28(30,32-22)17-23-25(3,4)33-23/h9,14-16,23,29-30H,8,10-13,17H2,1-7H3/b18-9+/t23?,26-,27-,28-/m1/s1
InChIKey BXTGGRXRZJVAIL-PNNFBKSSSA-N
Molecular Weight 456.623 g/mol
SMILES Oc1c(C\C=C\(CC2=C[C@@]3([C@]([C@](O2)(CC2OC2(C)C)O)(CCC3)C)C)C)cc(cc1C)OC
SPLASH splash10-0007-9810000000-d039c3e1698865d3f7eb
Source of Spectrum F-42-6019-7
Synonyms (1R,4aR,7aR)-1-[(3,3-dimethyl-2-oxiranyl)methyl]-3-[(2E)-4-(2-hydroxy-5-methoxy-3-methylphenyl)-2-methyl-2-butenyl]-4a,7a-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-ol
Wiley ID 1389410