| SpectraBase Compound ID | 9pw6DamPTek |
|---|---|
| InChI | InChI=1S/C48H76O20/c1-43(2)12-14-48(42(62)68-40-32(57)30(55)28(53)24(19-50)64-40)15-13-46(6)20(21(48)16-43)8-9-26-45(5)17-22(51)37(44(3,4)25(45)10-11-47(26,46)7)67-41-34(59)35(33(58)36(66-41)38(60)61)65-39-31(56)29(54)27(52)23(18-49)63-39/h8,21-37,39-41,49-59H,9-19H2,1-7H3,(H,60,61)/t21-,22-,23+,24+,25-,26+,27-,28+,29-,30-,31+,32+,33-,34+,35-,36-,37-,39-,40-,41-,45-,46+,47+,48-/m0/s1 |
| InChIKey | SSBSNRKCVRLAHE-NEEWOHJZSA-N |
| Mol Weight | 973.1 g/mol |
| Molecular Formula | C48H76O20 |
| Exact Mass | 972.492995 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 | 9fPgMA8sKgc |
|---|---|
| Name | CARYOCAROSIDE_IV-9;3-O-BETA-D-GALACTOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL-2-BETA-HYDROXYOLEANOLIC_ACID_28-O-BETA-GLUCOPYRANOSYLESTER |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H76O20 |
| InChI | InChI=1S/C48H76O20/c1-43(2)12-14-48(42(62)68-40-32(57)30(55)28(53)24(19-50)64-40)15-13-46(6)20(21(48)16-43)8-9-26-45(5)17-22(51)37(44(3,4)25(45)10-11-47(26,46)7)67-41-34(59)35(33(58)36(66-41)38(60)61)65-39-31(56)29(54)27(52)23(18-49)63-39/h8,21-37,39-41,49-59H,9-19H2,1-7H3,(H,60,61)/t21-,22-,23+,24+,25-,26+,27-,28+,29-,30-,31+,32+,33-,34+,35-,36-,37-,39-,40-,41-,45-,46+,47+,48-/m0/s1 |
| InChIKey | SSBSNRKCVRLAHE-NEEWOHJZSA-N |
| Literature Reference Author | A.A.MAGID,L.VOUTQUENNE,C.MORETTI,C.LONG,C.LAVAUD |
| Literature Reference Citation | J.NAT.PROD.,69,196(2006) |
| Literature Reference DOI | 10.1021/np050336s |
| Molecular Weight | 973.119 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ18497 |