| SpectraBase Compound ID | uQuffck2VB |
|---|---|
| InChI | InChI=1S/C55H83NO19/c1-28-46(58)36(63-8)22-43(67-28)73-48-30(3)69-45(24-38(48)65-10)75-49-31(4)70-44(25-39(49)66-11)74-47-29(2)68-42(23-37(47)64-9)71-35-15-16-51(6)34(21-35)14-17-54(61)40(51)26-41(72-50(59)33-13-12-20-56-27-33)52(7)53(60,32(5)57)18-19-55(52,54)62/h12-14,20,27-31,35-49,58,60-62H,15-19,21-26H2,1-11H3/t28-,29-,30-,31+,35+,36+,37+,38-,39-,40-,41-,42+,43-,44-,45+,46-,47-,48-,49+,51+,52-,53-,54+,55-/m1/s1 |
| InChIKey | ZANZUZKNPKKTQM-YTZKWRTKSA-N |
| Mol Weight | 1062.3 g/mol |
| Molecular Formula | C55H83NO19 |
| Exact Mass | 1061.555929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AggOXAMe69O |
|---|---|
| Name | ROSTRATAMINE-3-O-ALPHA-L-CYMAROPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSIDE |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H83NO19 |
| InChI | InChI=1S/C55H83NO19/c1-28-46(58)36(63-8)22-43(67-28)73-48-30(3)69-45(24-38(48)65-10)75-49-31(4)70-44(25-39(49)66-11)74-47-29(2)68-42(23-37(47)64-9)71-35-15-16-51(6)34(21-35)14-17-54(61)40(51)26-41(72-50(59)33-13-12-20-56-27-33)52(7)53(60,32(5)57)18-19-55(52,54)62/h12-14,20,27-31,35-49,58,60-62H,15-19,21-26H2,1-11H3/t28-,29-,30-,31+,35+,36+,37+,38-,39-,40-,41-,42+,43-,44-,45+,46-,47-,48-,49+,51+,52-,53-,54+,55-/m1/s1 |
| InChIKey | ZANZUZKNPKKTQM-YTZKWRTKSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,358(1996) |
| Literature Reference DOI | 10.1248/cpb.44.358 |
| Molecular Weight | 1062.259 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU31470 |