| SpectraBase Compound ID | E0uIGps7XR6 |
|---|---|
| InChI | InChI=1S/C64H96O23/c1-32(66)40-21-24-64(72)62(40,7)47(83-48(67)18-17-37-15-13-12-14-16-37)30-46-61(6)22-20-39(25-38(61)19-23-63(46,64)71)81-49-26-41(73-8)56(33(2)77-49)84-50-27-42(74-9)57(34(3)78-50)85-51-28-43(75-10)58(35(4)79-51)86-52-29-44(76-11)59(36(5)80-52)87-60-55(70)54(69)53(68)45(31-65)82-60/h12-19,33-36,39-47,49-60,65,68-72H,20-31H2,1-11H3/b18-17+/t33-,34+,35-,36+,39+,40+,41+,42-,43-,44+,45-,46-,47-,49+,50-,51+,52-,53-,54+,55-,56-,57+,58-,59+,60+,61+,62+,63+,64-/m1/s1 |
| InChIKey | JAMMHVQTGWZESN-BEXPXXHDSA-N |
| Mol Weight | 1233.4 g/mol |
| Molecular Formula | C64H96O23 |
| Exact Mass | 1232.634239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5qRPo63cqNG |
|---|---|
| Name | #24;SYRIACOSIDE-R;IKEMAGENIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSIDE-BE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C64H96O23 |
| InChI | InChI=1S/C64H96O23/c1-32(66)40-21-24-64(72)62(40,7)47(83-48(67)18-17-37-15-13-12-14-16-37)30-46-61(6)22-20-39(25-38(61)19-23-63(46,64)71)81-49-26-41(73-8)56(33(2)77-49)84-50-27-42(74-9)57(34(3)78-50)85-51-28-43(75-10)58(35(4)79-51)86-52-29-44(76-11)59(36(5)80-52)87-60-55(70)54(69)53(68)45(31-65)82-60/h12-19,33-36,39-47,49-60,65,68-72H,20-31H2,1-11H3/b18-17+/t33-,34+,35-,36+,39+,40+,41+,42-,43-,44+,45-,46-,47-,49+,50-,51+,52-,53-,54+,55-,56-,57+,58-,59+,60+,61+,62+,63+,64-/m1/s1 |
| InChIKey | JAMMHVQTGWZESN-BEXPXXHDSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,57,177(2009) |
| Literature Reference DOI | 10.1248/cpb.57.177 |
| Molecular Weight | 1233.452 g/mol |
| Sample ID | 2255 |
| Solvent | C5D5N |