| SpectraBase Compound ID | LigY8ilLUGt |
|---|---|
| InChI | InChI=1S/C59H94O30/c1-54(2)13-14-59(23(15-54)22-7-8-29-55(3)11-10-32(87-49-41(72)33(64)24(62)19-80-49)58(6,52(77)78)30(55)9-12-56(29,4)57(22,5)16-31(59)63)53(79)89-51-45(76)46(88-50-44(75)39(70)35(66)26(18-61)84-50)37(68)28(86-51)21-82-48-43(74)40(71)36(67)27(85-48)20-81-47-42(73)38(69)34(65)25(17-60)83-47/h7,23-51,60-76H,8-21H2,1-6H3,(H,77,78)/t23-,24+,25-,26-,27-,28-,29?,30?,31+,32-,33-,34+,35-,36-,37-,38+,39+,40+,41+,42-,43-,44-,45-,46?,47+,48-,49-,50+,51+,55+,56+,57+,58-,59+/m0/s1 |
| InChIKey | SXWOFRLEPIYRBS-LNONBYBQSA-N |
| Mol Weight | 1283.4 g/mol |
| Molecular Formula | C59H94O30 |
| Exact Mass | 1282.582992 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 | 932p35hear8 |
|---|---|
| Name | SAPONARIOSIDE-I;3-O-BETA-D-XYLOPYRANOSYL-16-ALPHA-HYDROXYGYPSOGENIC-ACID-28-O-ALPHA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL-(1->6)-[BETA-D- |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H94O30 |
| InChI | InChI=1S/C59H94O30/c1-54(2)13-14-59(23(15-54)22-7-8-29-55(3)11-10-32(87-49-41(72)33(64)24(62)19-80-49)58(6,52(77)78)30(55)9-12-56(29,4)57(22,5)16-31(59)63)53(79)89-51-45(76)46(88-50-44(75)39(70)35(66)26(18-61)84-50)37(68)28(86-51)21-82-48-43(74)40(71)36(67)27(85-48)20-81-47-42(73)38(69)34(65)25(17-60)83-47/h7,23-51,60-76H,8-21H2,1-6H3,(H,77,78)/t23-,24+,25-,26-,27-,28-,29?,30?,31+,32-,33-,34+,35-,36-,37-,38+,39+,40+,41+,42-,43-,44-,45-,46?,47+,48-,49-,50+,51+,55+,56+,57+,58-,59+/m0/s1 |
| InChIKey | SXWOFRLEPIYRBS-LNONBYBQSA-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 | 1283.377 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWRU466 |