SpectraBase Compound ID | JH4HR1EH5f1 |
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InChI | InChI=1S/C60H72O32/c1-14-37-39(21-47(70)76-19-18-36-16-17-43(81-29(5)63)44(20-36)82-30(6)64)41(55(72)74-12)23-79-57(37)91-60-54(87-35(11)69)52(85-33(9)67)50(46(89-60)26-78-28(4)62)90-48(71)22-40-38(15-2)58(80-24-42(40)56(73)75-13)92-59-53(86-34(10)68)51(84-32(8)66)49(83-31(7)65)45(88-59)25-77-27(3)61/h14-17,20,23-24,39-40,45-46,49-54,57-60H,18-19,21-22,25-26H2,1-13H3/b37-14-,38-15-/t39-,40+,45+,46-,49+,50-,51-,52+,53+,54-,57-,58+,59-,60+/m0/s1 |
InChIKey | RZBCEPKXYWJVKS-OAZIPABJSA-N |
Mol Weight | 1305.2 g/mol |
Molecular Formula | C60H72O32 |
Exact Mass | 1304.40067 g/mol |
SpectraBase Spectrum ID | DN1j9LxAlyV |
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Name | RZBCEPKXYWJVKS-OAZIPABJSA-N |
Compound Number | 20 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C60H72O32 |
InChI | InChI=1S/C60H72O32/c1-14-37-39(21-47(70)76-19-18-36-16-17-43(81-29(5)63)44(20-36)82-30(6)64)41(55(72)74-12)23-79-57(37)91-60-54(87-35(11)69)52(85-33(9)67)50(46(89-60)26-78-28(4)62)90-48(71)22-40-38(15-2)58(80-24-42(40)56(73)75-13)92-59-53(86-34(10)68)51(84-32(8)66)49(83-31(7)65)45(88-59)25-77-27(3)61/h14-17,20,23-24,39-40,45-46,49-54,57-60H,18-19,21-22,25-26H2,1-13H3/b37-14-,38-15-/t39-,40+,45+,46-,49+,50-,51-,52+,53+,54-,57-,58+,59-,60+/m0/s1 |
InChIKey | RZBCEPKXYWJVKS-OAZIPABJSA-N |
Literature Reference Author | T.TANAHASHI,Y.TAKENAKA,M.AKIMOTO,A.OKUDA,Y.KUSUNOKI,C.SUEKAW A,N.NAGAKURA |
Literature Reference Citation | CHEM.PHARM.BULL.,45,367(1997) |
Literature Reference DOI | 10.1248/cpb.45.367 |
Molecular Weight | 1305.212 g/mol |
Solvent | CDCl3 |
Source File Reference | UWMZ22374 |