| SpectraBase Compound ID | FcoPQKxZHdF |
|---|---|
| InChI | InChI=1S/C47H76O19/c1-21-29(51)31(53)34(56)39(62-21)65-37-24(18-48)63-38(36(58)33(37)55)61-19-25-30(52)32(54)35(57)40(64-25)66-41(59)47-15-13-42(2,60)17-23(47)22-7-8-27-43(3)11-10-28(50)44(4,20-49)26(43)9-12-46(27,6)45(22,5)14-16-47/h7,21,23-40,48-58,60H,8-20H2,1-6H3/t21-,23+,24-,25-,26-,27-,28+,29-,30-,31+,32+,33-,34+,35-,36-,37-,38-,39+,40+,42-,43+,44+,45-,46-,47+/m1/s1 |
| InChIKey | LZTJOTPKQYCXHR-WMWOOBEUSA-N |
| Mol Weight | 945.1 g/mol |
| Molecular Formula | C47H76O19 |
| Exact Mass | 944.49808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BUspDbEgjfl |
|---|---|
| Name | NIPPONOSIDE-E;20-ALPHA-HYDROXYL-30-NOR-HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O19 |
| InChI | InChI=1S/C47H76O19/c1-21-29(51)31(53)34(56)39(62-21)65-37-24(18-48)63-38(36(58)33(37)55)61-19-25-30(52)32(54)35(57)40(64-25)66-41(59)47-15-13-42(2,60)17-23(47)22-7-8-27-43(3)11-10-28(50)44(4,20-49)26(43)9-12-46(27,6)45(22,5)14-16-47/h7,21,23-40,48-58,60H,8-20H2,1-6H3/t21-,23+,24-,25-,26-,27-,28+,29-,30-,31+,32+,33-,34+,35-,36-,37-,38-,39+,40+,42-,43+,44+,45-,46-,47+/m1/s1 |
| InChIKey | LZTJOTPKQYCXHR-WMWOOBEUSA-N |
| Literature Reference Author | M.MIYAKOSHI,K.SHIRASUNA,Y.HIRAI,K.SHINGU,S.ISODA,J.SHOJI,Y.I DA,T.SHIMIZU |
| Literature Reference Citation | J.NAT.PROD.,62,445(1999) |
| Literature Reference DOI | 10.1021/np9804334 |
| Molecular Weight | 945.109 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP7889 |