SpectraBase Compound ID | DVhIQjl0PTH |
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InChI | InChI=1S/C56H84O19/c1-29-47(58)37(63-8)24-44(67-29)73-49-31(3)69-46(26-39(49)65-10)75-50-32(4)70-45(27-40(50)66-11)74-48-30(2)68-43(25-38(48)64-9)71-36-18-19-52(6)35(23-36)17-20-55(61)41(52)28-42(72-51(59)34-15-13-12-14-16-34)53(7)54(60,33(5)57)21-22-56(53,55)62/h12-17,29-32,36-50,58,60-62H,18-28H2,1-11H3/t29-,30+,31+,32+,36?,37+,38-,39-,40+,41?,42?,43-,44+,45+,46-,47-,48+,49+,50-,52?,53?,54?,55?,56?/m0/s1 |
InChIKey | PTVMWMUODZCOFZ-APEUSLBUSA-N |
Mol Weight | 1061.3 g/mol |
Molecular Formula | C56H84O19 |
Exact Mass | 1060.56068 g/mol |
SpectraBase Spectrum ID | BEWsAGC5wTI |
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Name | CYNANFORIDINE-3-O-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-ALPHA-L-DIGINOPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSIDE |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C56H84O19 |
InChI | InChI=1S/C56H84O19/c1-29-47(58)37(63-8)24-44(67-29)73-49-31(3)69-46(26-39(49)65-10)75-50-32(4)70-45(27-40(50)66-11)74-48-30(2)68-43(25-38(48)64-9)71-36-18-19-52(6)35(23-36)17-20-55(61)41(52)28-42(72-51(59)34-15-13-12-14-16-34)53(7)54(60,33(5)57)21-22-56(53,55)62/h12-17,29-32,36-50,58,60-62H,18-28H2,1-11H3/t29-,30+,31+,32+,36?,37+,38-,39-,40+,41?,42?,43-,44+,45+,46-,47-,48+,49+,50-,52?,53?,54?,55?,56?/m0/s1 |
InChIKey | PTVMWMUODZCOFZ-APEUSLBUSA-N |
Literature Reference Author | S.TSUKAMOTO,K.HAYASHI,H.MITSUHASHI |
Literature Reference Citation | CHEM.PHARM.BULL.,33,2294(1985) |
Literature Reference DOI | 10.1248/cpb.33.2294 |
Molecular Weight | 1061.272 g/mol |
Solvent | PYRIDINE-D5 |
Source File Reference | UWBK1245 |