| SpectraBase Compound ID | xq2XRarxVV |
|---|---|
| InChI | InChI=1S/C58H92O26/c1-22-32(62)34(64)38(68)48(77-22)81-43-27(60)21-75-47(41(43)71)80-42-23(2)78-49(40(70)37(42)67)83-45-33(63)26(59)20-76-51(45)84-52(74)58-17-16-53(3,4)18-25(58)24-10-11-29-55(7)14-13-31(79-50-39(69)35(65)36(66)44(82-50)46(72)73)54(5,6)28(55)12-15-56(29,8)57(24,9)19-30(58)61/h10,22-23,25-45,47-51,59-71H,11-21H2,1-9H3,(H,72,73)/t22-,23+,25+,26+,27+,28+,29-,30-,31+,32-,33+,34+,35+,36+,37+,38+,39-,40-,41+,42+,43-,44+,45-,47-,48-,49+,50-,51+,55+,56-,57-,58-/m1/s1 |
| InChIKey | QPXNKOURCNDMOU-IATPOYLZSA-N |
| Mol Weight | 1205.3 g/mol |
| Molecular Formula | C58H92O26 |
| Exact Mass | 1204.587683 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G3wnZnnRgNW |
|---|---|
| Name | RYOBUSAPONIN-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H92O26 |
| InChI | InChI=1S/C58H92O26/c1-22-32(62)34(64)38(68)48(77-22)81-43-27(60)21-75-47(41(43)71)80-42-23(2)78-49(40(70)37(42)67)83-45-33(63)26(59)20-76-51(45)84-52(74)58-17-16-53(3,4)18-25(58)24-10-11-29-55(7)14-13-31(79-50-39(69)35(65)36(66)44(82-50)46(72)73)54(5,6)28(55)12-15-56(29,8)57(24,9)19-30(58)61/h10,22-23,25-45,47-51,59-71H,11-21H2,1-9H3,(H,72,73)/t22-,23+,25+,26+,27+,28+,29-,30-,31+,32-,33+,34+,35+,36+,37+,38+,39-,40-,41+,42+,43-,44+,45-,47-,48-,49+,50-,51+,55+,56-,57-,58-/m1/s1 |
| InChIKey | QPXNKOURCNDMOU-IATPOYLZSA-N |
| Literature Reference Author | T.MURATA,A.SUYUKI,N.MAFUNE,E.SATO,T.MIYASE,F.YOSHIZAKI |
| Literature Reference Citation | CHEM.PHARM.BULL.,61,134(2013) |
| Literature Reference DOI | 10.1248/cpb.c12-00566 |
| Molecular Weight | 1205.353 g/mol |
| Source File Reference | UWBT4839 |