SpectraBase Compound ID | 4oOjdrOi4X1 |
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InChI | InChI=1S/C52H84O22/c1-20(19-66-47-40(61)39(60)36(57)31(17-53)71-47)14-30(65-7)44-21(2)33-29(70-44)16-28-26-9-8-24-15-25(10-12-51(24,5)27(26)11-13-52(28,33)6)69-50-46(74-49-42(63)38(59)35(56)23(4)68-49)43(64)45(32(18-54)72-50)73-48-41(62)37(58)34(55)22(3)67-48/h8,20,22-23,25-43,45-50,53-64H,9-19H2,1-7H3/t20-,22+,23+,25+,26?,27?,28?,29+,30-,31-,32-,33+,34+,35+,36-,37-,38-,39+,40-,41-,42-,43+,45-,46-,47-,48+,49+,50-,51+,52+/m1/s1 |
InChIKey | GOKDEZKNKCIMJT-GMDAPZQVSA-N |
Mol Weight | 1061.2 g/mol |
Molecular Formula | C52H84O22 |
Exact Mass | 1060.545424 g/mol |
SpectraBase Spectrum ID | ARKb5XM4CeK |
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Name | DIOSCORESIDE_C |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C52H84O22 |
InChI | InChI=1S/C52H84O22/c1-20(19-66-47-40(61)39(60)36(57)31(17-53)71-47)14-30(65-7)44-21(2)33-29(70-44)16-28-26-9-8-24-15-25(10-12-51(24,5)27(26)11-13-52(28,33)6)69-50-46(74-49-42(63)38(59)35(56)23(4)68-49)43(64)45(32(18-54)72-50)73-48-41(62)37(58)34(55)22(3)67-48/h8,20,22-23,25-43,45-50,53-64H,9-19H2,1-7H3/t20-,22+,23+,25+,26?,27?,28?,29+,30-,31-,32-,33+,34+,35+,36-,37-,38-,39+,40-,41-,42-,43+,45-,46-,47-,48+,49+,50-,51+,52+/m1/s1 |
InChIKey | GOKDEZKNKCIMJT-GMDAPZQVSA-N |
Literature Reference Author | M.DONG,X.FENG,L.WU,B.WANG,T.IKEJIMA |
Literature Reference Citation | PLANTA.MED.,67,853(2001) |
Literature Reference DOI | 10.1055/s-2001-18856 |
Molecular Weight | 1061.226 g/mol |
Solvent | C5D5N |
Source File Reference | UIAP1638 |