![SAPONARIOSIDE-K;3,4-SECO-16-ALPHA-HYDROXY-GYPSOGENIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/GaG1Ew7Jvkq/structure.png?h=300&w=458 "SAPONARIOSIDE-K;3,4-SECO-16-ALPHA-HYDROXY-GYPSOGENIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | 9GkUEKhfE0N |
|---|---|
| InChI | InChI=1S/C48H76O21/c1-21(39(61)62)22-10-12-46(5)28(45(22,4)11-7-15-49)9-8-23-24-16-44(2,3)13-14-48(24,29(52)17-47(23,46)6)43(63)69-42-37(60)38(68-41-36(59)34(57)31(54)26(19-51)66-41)32(55)27(67-42)20-64-40-35(58)33(56)30(53)25(18-50)65-40/h8,22,24-38,40-42,49-60H,1,7,9-20H2,2-6H3,(H,61,62)/t22?,24-,25+,26+,27+,28?,29+,30+,31+,32+,33-,34-,35+,36+,37+,38-,40+,41-,42-,45-,46+,47+,48+/m0/s1 |
| InChIKey | WQTDUOHTGZBHNH-CWEDKCROSA-N |
| Mol Weight | 989.1 g/mol |
| Molecular Formula | C48H76O21 |
| Exact Mass | 988.487909 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 | GaG1Ew7Jvkq |
|---|---|
| Name | SAPONARIOSIDE-K;3,4-SECO-16-ALPHA-HYDROXY-GYPSOGENIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H76O21 |
| InChI | InChI=1S/C48H76O21/c1-21(39(61)62)22-10-12-46(5)28(45(22,4)11-7-15-49)9-8-23-24-16-44(2,3)13-14-48(24,29(52)17-47(23,46)6)43(63)69-42-37(60)38(68-41-36(59)34(57)31(54)26(19-51)66-41)32(55)27(67-42)20-64-40-35(58)33(56)30(53)25(18-50)65-40/h8,22,24-38,40-42,49-60H,1,7,9-20H2,2-6H3,(H,61,62)/t22?,24-,25+,26+,27+,28?,29+,30+,31+,32+,33-,34-,35+,36+,37+,38-,40+,41-,42-,45-,46+,47+,48+/m0/s1 |
| InChIKey | WQTDUOHTGZBHNH-CWEDKCROSA-N |
| Literature Reference Author | K.KOIKE,Z.JIA,T.NIKAIDO |
| Literature Reference Citation | J.NAT.PROD.,62,1655(1999) |
| Literature Reference DOI | 10.1021/np990311r |
| Molecular Weight | 989.119 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWRU468 |