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#2;PERIPEROXIDE-B;PREGN-5-ENE-3-BETA,17-ALPHA,20S-TRIOL-3-O-(4,6-DIDEOXY-3-METHOXY-2-HEXOSULOSIDE-3-ENE)-20-O-4-O-ACETYL-BETA-CYMAROPYRANOSYL-(1->4)-O-BETA-CYM

Compound with spectra: 1 NMR

#2;PERIPEROXIDE-B;PREGN-5-ENE-3-BETA,17-ALPHA,20S-TRIOL-3-O-(4,6-DIDEOXY-3-METHOXY-2-HEXOSULOSIDE-3-ENE)-20-O-4-O-ACETYL-BETA-CYMAROPYRANOSYL-(1->4)-O-BETA-CYM
SpectraBase Compound ID IT9yOdv7ulK
InChI InChI=1S/C71H112O26/c1-34-25-49(76-12)60(74)67(82-34)90-44-19-22-68(10)43(26-44)17-18-45-46(68)20-23-69(11)47(45)21-24-71(69,75)41(8)88-56-31-53-66(39(6)87-56)96-97-70(33-81-53)32-54(80-16)65(40(7)95-70)94-59-30-52(79-15)63(37(4)86-59)92-55-27-48(73)61(35(2)83-55)91-57-29-51(78-14)64(38(5)85-57)93-58-28-50(77-13)62(36(3)84-58)89-42(9)72/h17,25,34-41,44-48,50-59,61-67,73,75H,18-24,26-33H2,1-16H3/t34-,35+,36-,37+,38+,39+,40+,41-,44+,45-,46+,47+,48+,50+,51-,52-,53+,54-,55-,56-,57-,58+,59-,61+,62-,63+,64+,65+,66+,67+,68+,69+,70-,71+/m1/s1
InChIKey XMRMWAHPQIKBRO-HBRUVLOZSA-N
Mol Weight 1381.7 g/mol
Molecular Formula C71H112O26
Exact Mass 1380.744184 g/mol
Enantiomer InChIKey XMRMWAHPQIKBRO-FPUXTZDBSA-N

View Spectrum of #2;PERIPEROXIDE-B;PREGN-5-ENE-3-BETA,17-ALPHA,20S-TRIOL-3-O-(4,6-DIDEOXY-3-METHOXY-2-HEXOSULOSIDE-3-ENE)-20-O-4-O-ACETYL-BETA-CYMAROPYRANOSYL-(1->4)-O-BETA-CYM

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Immunosuppressive pregnane glycosides from Periploca sepium and Periploca forrestii Phytochemistry 2008

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