SpectraBase Compound ID | FIhSuO3w4a0 |
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InChI | InChI=1S/C46H58O25/c1-4-22-23(24(42(61)62-3)18-64-43(22)71-45-38(60)36(58)34(56)29(16-47)66-45)15-32(54)69-41-40(70-44-37(59)35(57)33(55)19(2)65-44)39(68-31(53)10-7-20-5-8-25(49)27(51)13-20)30(17-48)67-46(41)63-12-11-21-6-9-26(50)28(52)14-21/h4-10,13-14,18-19,23,29-30,33-41,43-52,55-60H,11-12,15-17H2,1-3H3/b10-7+,22-4-/t19-,23+,29+,30+,33-,34+,35+,36-,37+,38+,39+,40-,41+,43+,44-,45-,46+/m0/s1 |
InChIKey | GFUDEKPTNHEBOW-ATDLFSNJSA-N |
Mol Weight | 1010.9 g/mol |
Molecular Formula | C46H58O25 |
Exact Mass | 1010.326717 g/mol |
SpectraBase Spectrum ID | CxUaLwNKnez |
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Name | OLEOACETOSIDE |
Compound Number | 222 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C46H58O25 |
InChI | InChI=1S/C46H58O25/c1-4-22-23(24(42(61)62-3)18-64-43(22)71-45-38(60)36(58)34(56)29(16-47)66-45)15-32(54)69-41-40(70-44-37(59)35(57)33(55)19(2)65-44)39(68-31(53)10-7-20-5-8-25(49)27(51)13-20)30(17-48)67-46(41)63-12-11-21-6-9-26(50)28(52)14-21/h4-10,13-14,18-19,23,29-30,33-41,43-52,55-60H,11-12,15-17H2,1-3H3/b10-7+,22-4-/t19-,23+,29+,30+,33-,34+,35+,36-,37+,38+,39+,40-,41+,43+,44-,45-,46+/m0/s1 |
InChIKey | GFUDEKPTNHEBOW-ATDLFSNJSA-N |
Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
Literature Reference Citation | J.NAT.PROD.,54,1173(1991) |
Literature Reference DOI | 10.1021/np50077a001 |
Molecular Weight | 1010.952 g/mol |
Solvent | CD3OD |
Source File Reference | UWCS4520 |