| SpectraBase Compound ID | 7WtvOOAgO4J |
|---|---|
| InChI | InChI=1S/C52H84O20/c1-23-32(56)40(71-42-37(61)39(27(55)22-65-42)70-43-36(60)35(59)34(58)28(20-53)68-43)38(62)44(67-23)72-41-33(57)26(54)21-66-45(41)69-31-12-13-49(6)29(48(31,4)5)11-14-51(8)30(49)10-9-24-25-19-47(2,3)15-17-52(25,46(63)64)18-16-50(24,51)7/h9,23,25-45,53-62H,10-22H2,1-8H3,(H,63,64)/t23-,25-,26+,27+,28+,29-,30+,31-,32-,33-,34+,35-,36+,37+,38+,39-,40+,41+,42-,43+,44-,45-,49-,50+,51+,52-/m0/s1 |
| InChIKey | IYOGZFZZTWXNJP-QKYGBCOBSA-N |
| Mol Weight | 1029.2 g/mol |
| Molecular Formula | C52H84O20 |
| Exact Mass | 1028.555595 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ID2cVFE7MRK |
|---|---|
| Name | PROSAPOGENIN-BX;OLEANOLIC-ACID-3-O-ALPHA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->3)-ALPHA-L-RHAMPYRANOSYL-(1->2)-BETA-D-XYLOPYRANOSIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H84O20 |
| InChI | InChI=1S/C52H84O20/c1-23-32(56)40(71-42-37(61)39(27(55)22-65-42)70-43-36(60)35(59)34(58)28(20-53)68-43)38(62)44(67-23)72-41-33(57)26(54)21-66-45(41)69-31-12-13-49(6)29(48(31,4)5)11-14-51(8)30(49)10-9-24-25-19-47(2,3)15-17-52(25,46(63)64)18-16-50(24,51)7/h9,23,25-45,53-62H,10-22H2,1-8H3,(H,63,64)/t23-,25-,26+,27+,28+,29-,30+,31-,32-,33-,34+,35-,36+,37+,38+,39-,40+,41+,42-,43+,44-,45-,49-,50+,51+,52-/m0/s1 |
| InChIKey | IYOGZFZZTWXNJP-QKYGBCOBSA-N |
| Literature Reference Author | J.TIAN,F.E.WU,M.H.QIU,R.L.NIE |
| Literature Reference Citation | PHYTOCHEM.,32,1539(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85175-Q |
| Molecular Weight | 1029.227 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU6635 |