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7-[(Acetyloxy)methyl]-1-((2,3,4-tri-O-acetyl-6-O-[(2E)-3-phenyl-2-propenoyl]hexopyranosyl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl acetate

View entire compound with spectra: 1 MS (GC)

7-[(Acetyloxy)methyl]-1-((2,3,4-tri-O-acetyl-6-O-[(2E)-3-phenyl-2-propenoyl]hexopyranosyl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl acetate
SpectraBase Compound ID HiUEXl2t3mt
InChI InChI=1S/C34H38O15/c1-18(35)42-16-24-15-26(44-19(2)36)25-13-14-41-33(29(24)25)49-34-32(47-22(5)39)31(46-21(4)38)30(45-20(3)37)27(48-34)17-43-28(40)12-11-23-9-7-6-8-10-23/h6-15,25-27,29-34H,16-17H2,1-5H3/b12-11+/t25?,26?,27-,29?,30-,31-,32-,33?,34+/m0/s1
InChIKey RWSVWKDKAMNOLP-VOLWLQBKSA-N
Mol Weight 686.7 g/mol
Molecular Formula C34H38O15
Exact Mass 686.221071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GjfU37T0VHs
Name 7-[(Acetyloxy)methyl]-1-((2,3,4-tri-O-acetyl-6-O-[(2E)-3-phenyl-2-propenoyl]hexopyranosyl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl acetate
Alternate Name(s) .beta.-d-Glucopyranoside, 5-(acetyloxy)-7-[(acetyloxy)methyl]-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl, 2,3,4-triacetate 6-(3-phenyl-2-propenoate), [1s-[1.al [3,4,5-triacetoxy-6-[[5-acetoxy-7-(acetoxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]tetrahydropyran-2-yl]methyl (E)-3-phenylprop-2-enoate [3,4,5-triacetyloxy-6-[[5-acetyloxy-7-(acetyloxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]oxan-2-yl]methyl (E)-3-phenylprop-2-enoate (E)-3-phenyl-2-propenoic acid [3,4,5-triacetyloxy-6-[[5-acetyloxy-7-(acetyloxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-2-oxanyl]methyl ester
CAS Registry Number 75228-20-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H38O15
InChI InChI=1S/C34H38O15/c1-18(35)42-16-24-15-26(44-19(2)36)25-13-14-41-33(29(24)25)49-34-32(47-22(5)39)31(46-21(4)38)30(45-20(3)37)27(48-34)17-43-28(40)12-11-23-9-7-6-8-10-23/h6-15,25-27,29-34H,16-17H2,1-5H3/b12-11+/t25?,26?,27-,29?,30-,31-,32-,33?,34+/m0/s1
InChIKey RWSVWKDKAMNOLP-VOLWLQBKSA-N
Molecular Weight 686.663 g/mol
SMILES CC(O[C@]1([C@]([C@@](O[C@@]([C@]1(OC(=O)C)[H])(OC1OC=CC2C1C(COC(=O)C)=CC2OC(=O)C)[H])(COC(=O)\C=C\c1ccccc1)[H])(OC(=O)C)[H])[H])=O
SPLASH splash10-00lr-2910600000-ae41878862ede0cd2675
Wiley ID 1485370