| SpectraBase Compound ID | 4whBWG2twrD |
|---|---|
| InChI | InChI=1S/C59H96O26/c1-24-34(63)38(67)42(71)49(78-24)83-46-29(21-61)80-48(45(74)41(46)70)77-23-30-37(66)40(69)44(73)51(81-30)85-53(75)59-17-15-54(2,3)19-26(59)25-9-10-32-56(6)13-12-33(55(4,5)31(56)11-14-58(32,8)57(25,7)16-18-59)82-52-47(35(64)27(62)22-76-52)84-50-43(72)39(68)36(65)28(20-60)79-50/h9,24,26-52,60-74H,10-23H2,1-8H3/t24-,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?,56-,57+,58+,59?/m0/s1 |
| InChIKey | JYQWZASHCQTVLM-PLPKLOMUSA-N |
| Mol Weight | 1221.4 g/mol |
| Molecular Formula | C59H96O26 |
| Exact Mass | 1220.618983 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BxzOusEh3x1 |
|---|---|
| Name | CIWUJIANOSIDE_A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H96O26 |
| InChI | InChI=1S/C59H96O26/c1-24-34(63)38(67)42(71)49(78-24)83-46-29(21-61)80-48(45(74)41(46)70)77-23-30-37(66)40(69)44(73)51(81-30)85-53(75)59-17-15-54(2,3)19-26(59)25-9-10-32-56(6)13-12-33(55(4,5)31(56)11-14-58(32,8)57(25,7)16-18-59)82-52-47(35(64)27(62)22-76-52)84-50-43(72)39(68)36(65)28(20-60)79-50/h9,24,26-52,60-74H,10-23H2,1-8H3/t24-,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?,56-,57+,58+,59?/m0/s1 |
| InChIKey | JYQWZASHCQTVLM-PLPKLOMUSA-N |
| Literature Reference Author | H.M.ZHONG,C.X.CHEN,X.TIAN,Y.X.CHUI,Y.Z.CHEN |
| Literature Reference Citation | PLANTA.MED.,67,484(2001) |
| Literature Reference DOI | 10.1055/s-2001-15803 |
| Molecular Weight | 1221.396 g/mol |
| Solvent | C5D5N |
| Source File Reference | UIAP1585 |