| SpectraBase Compound ID | 9uShuvyr8t5 |
|---|---|
| InChI | InChI=1S/C58H98O30/c1-21(20-78-51-44(73)40(69)36(65)30(15-59)80-51)8-11-58(77-5)22(2)35-29(88-58)13-26-24-7-6-23-12-28(27(64)14-57(23,4)25(24)9-10-56(26,35)3)79-52-47(76)43(72)48(34(19-63)84-52)85-55-50(87-54-46(75)42(71)38(67)32(17-61)82-54)49(39(68)33(18-62)83-55)86-53-45(74)41(70)37(66)31(16-60)81-53/h21-55,59-76H,6-20H2,1-5H3/t21-,22+,23+,24-,25+,26+,27-,28-,29+,30+,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46-,47+,48-,49+,50-,51+,52+,53-,54+,55+,56+,57+,58-/m1/s1 |
| InChIKey | XWRUXKJSSDFCCN-FMISLBLMSA-N |
| Mol Weight | 1275.4 g/mol |
| Molecular Formula | C58H98O30 |
| Exact Mass | 1274.614292 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E3dIs4iGTBW |
|---|---|
| Name | CAPSICOSIDE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H98O30 |
| InChI | InChI=1S/C58H98O30/c1-21(20-78-51-44(73)40(69)36(65)30(15-59)80-51)8-11-58(77-5)22(2)35-29(88-58)13-26-24-7-6-23-12-28(27(64)14-57(23,4)25(24)9-10-56(26,35)3)79-52-47(76)43(72)48(34(19-63)84-52)85-55-50(87-54-46(75)42(71)38(67)32(17-61)82-54)49(39(68)33(18-62)83-55)86-53-45(74)41(70)37(66)31(16-60)81-53/h21-55,59-76H,6-20H2,1-5H3/t21-,22+,23+,24-,25+,26+,27-,28-,29+,30+,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46-,47+,48-,49+,50-,51+,52+,53-,54+,55+,56+,57+,58-/m1/s1 |
| InChIKey | XWRUXKJSSDFCCN-FMISLBLMSA-N |
| Literature Reference Author | S.YAHARA,T.URA,C.SAKAMOTO,T.NOHARA |
| Literature Reference Citation | PHYTOCHEM.,37,831(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90366-2 |
| Molecular Weight | 1275.398 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU23510 |