| SpectraBase Compound ID | LSyUJ6KAZ2Y |
|---|---|
| InChI | InChI=1S/C50H69NO30/c1-19-36(41(71-25(7)57)45(75-29(11)61)48(64-14)68-19)51-33-15-32(16-65-20(2)52)37(42(72-26(8)58)38(33)69-23(5)55)80-49-47(77-31(13)63)44(74-28(10)60)40(35(79-49)18-67-22(4)54)81-50-46(76-30(12)62)43(73-27(9)59)39(70-24(6)56)34(78-50)17-66-21(3)53/h15,19,33-51H,16-18H2,1-14H3/t19-,33-,34+,35-,36-,37-,38+,39+,40-,41+,42+,43-,44+,45-,46+,47-,48-,49+,50-/m1/s1 |
| InChIKey | GKQCEEVWOFVPTQ-ZBOYMQIESA-N |
| Mol Weight | 1164.1 g/mol |
| Molecular Formula | C50H69NO30 |
| Exact Mass | 1163.39044 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GMSN4ZCFDh3 |
|---|---|
| Name | METHYL-BETA-ACARVIOSIN-4''-O-(2''',3''',4''',6'''-TETRAACETOXY)-BETA-D-GLUCOPYRANOSYL-(1->4)-(2'',3'',6''-TRIACETOXY)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 18 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H69NO30 |
| InChI | InChI=1S/C50H69NO30/c1-19-36(41(71-25(7)57)45(75-29(11)61)48(64-14)68-19)51-33-15-32(16-65-20(2)52)37(42(72-26(8)58)38(33)69-23(5)55)80-49-47(77-31(13)63)44(74-28(10)60)40(35(79-49)18-67-22(4)54)81-50-46(76-30(12)62)43(73-27(9)59)39(70-24(6)56)34(78-50)17-66-21(3)53/h15,19,33-51H,16-18H2,1-14H3/t19-,33-,34+,35-,36-,37-,38+,39+,40-,41+,42+,43-,44+,45-,46+,47-,48-,49+,50-/m1/s1 |
| InChIKey | GKQCEEVWOFVPTQ-ZBOYMQIESA-N |
| Literature Reference Author | J.K.FAIRWEATHER,M.J.MCDONOUGH,R.V.STICK,D.M.G.TILBROOK |
| Literature Reference Citation | AUSTR.J.CHEM.,57,197(2004) |
| Literature Reference DOI | 10.1071/CH03203 |
| Molecular Weight | 1164.087 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN7465 |