![ROSTRATAMINE-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSIDE]](/api/spectrum/9pkMv8gGvvx/structure.png?h=300&w=458 "ROSTRATAMINE-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSIDE]")
| SpectraBase Compound ID | L2kLPDh4ANo |
|---|---|
| InChI | InChI=1S/C52H77NO19/c1-25-43(58)36(63-8)22-42(64-25)72-46-28(4)67-41(21-35(46)57)71-45-27(3)66-40(20-34(45)56)70-44-26(2)65-39(19-33(44)55)68-32-12-13-48(6)31(18-32)11-14-51(61)37(48)23-38(69-47(59)30-10-9-17-53-24-30)49(7)50(60,29(5)54)15-16-52(49,51)62/h9-11,17,24-28,32-46,55-58,60-62H,12-16,18-23H2,1-8H3/t25-,26-,27-,28-,32-,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+,43-,44-,45-,46-,48-,49+,50+,51-,52+/m0/s1 |
| InChIKey | UBAKOEYTWKHWJA-YOPUQKIPSA-N |
| Mol Weight | 1020.2 g/mol |
| Molecular Formula | C52H77NO19 |
| Exact Mass | 1019.508979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9pkMv8gGvvx |
|---|---|
| Name | ROSTRATAMINE-3-O-BETA-D-[OLEANDROPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSYL-(1->4)-DIGITOXOPYRANOSIDE] |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H77NO19 |
| InChI | InChI=1S/C52H77NO19/c1-25-43(58)36(63-8)22-42(64-25)72-46-28(4)67-41(21-35(46)57)71-45-27(3)66-40(20-34(45)56)70-44-26(2)65-39(19-33(44)55)68-32-12-13-48(6)31(18-32)11-14-51(61)37(48)23-38(69-47(59)30-10-9-17-53-24-30)49(7)50(60,29(5)54)15-16-52(49,51)62/h9-11,17,24-28,32-46,55-58,60-62H,12-16,18-23H2,1-8H3/t25-,26-,27-,28-,32-,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+,43-,44-,45-,46-,48-,49+,50+,51-,52+/m0/s1 |
| InChIKey | UBAKOEYTWKHWJA-YOPUQKIPSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | PHYTOCHEM.,53,485(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00560-9 |
| Molecular Weight | 1020.179 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU2043 |