SpectraBase Compound ID | 4BF8ikKSyON |
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InChI | InChI=1S/C52H84O22/c1-20(19-66-47-39(61)38(60)35(57)29(17-53)71-47)8-11-28-21(2)31-45(70-28)44(65-7)32-26-10-9-24-16-25(12-14-51(24,5)27(26)13-15-52(31,32)6)69-50-46(74-49-41(63)37(59)34(56)23(4)68-49)42(64)43(30(18-54)72-50)73-48-40(62)36(58)33(55)22(3)67-48/h9,20,22-23,25-27,29-50,53-64H,8,10-19H2,1-7H3/t20-,22-,23-,25-,26+,27-,29+,30+,31-,32+,33-,34-,35+,36+,37+,38-,39+,40+,41+,42-,43+,44?,45+,46+,47+,48-,49-,50+,51-,52+/m0/s1 |
InChIKey | FEIHPQZUCHSYKB-NIWMGAPNSA-N |
Mol Weight | 1061.2 g/mol |
Molecular Formula | C52H84O22 |
Exact Mass | 1060.545424 g/mol |
SpectraBase Spectrum ID | LQ37TiVVVgu |
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Name | #2;15-METHOXY-PSEUDOPROTODIOSCIN;(25R)-26-O-BETA-D-GLUCOPYRANOSYL-5,20-DIENE-15-METHOXY-3-BETA,26-DIHYDROXY-FUROST-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]- |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C52H84O22 |
InChI | InChI=1S/C52H84O22/c1-20(19-66-47-39(61)38(60)35(57)29(17-53)71-47)8-11-28-21(2)31-45(70-28)44(65-7)32-26-10-9-24-16-25(12-14-51(24,5)27(26)13-15-52(31,32)6)69-50-46(74-49-41(63)37(59)34(56)23(4)68-49)42(64)43(30(18-54)72-50)73-48-40(62)36(58)33(55)22(3)67-48/h9,20,22-23,25-27,29-50,53-64H,8,10-19H2,1-7H3/t20-,22-,23-,25-,26+,27-,29+,30+,31-,32+,33-,34-,35+,36+,37+,38-,39+,40+,41+,42-,43+,44?,45+,46+,47+,48-,49-,50+,51-,52+/m0/s1 |
InChIKey | FEIHPQZUCHSYKB-NIWMGAPNSA-N |
Literature Reference Author | H.L.HUANG,T.H.LIU,F.SHAO |
Literature Reference Citation | MAGN.RES.CHEM.,47,741(2009) |
Literature Reference DOI | 10.1002/mrc.2455 |
Molecular Weight | 1061.226 g/mol |
Solvent | C5D5N |
Source File Reference | UWLU80029 |