| SpectraBase Compound ID | AVQYJyM9E2P |
|---|---|
| InChI | InChI=1S/C43H68O18/c1-23(2)9-5-14-26(15-7-12-24(3)10-6-11-25(4)13-8-16-27-17-31(47)55-22-27)21-56-42-39(36(52)33(49)29(19-45)58-42)61-43-40(37(53)34(50)30(20-46)59-43)60-41-38(54)35(51)32(48)28(18-44)57-41/h9-10,13,15,17,28-30,32-46,48-54H,5-8,11-12,14,16,18-22H2,1-4H3/b24-10+,25-13+,26-15-/t28-,29+,30-,32-,33+,34-,35+,36-,37+,38-,39+,40-,41+,42+,43+/m1/s1 |
| InChIKey | QHEBCCVHGGITAV-DSUQVKGJSA-N |
| Mol Weight | 873.0 g/mol |
| Molecular Formula | C43H68O18 |
| Exact Mass | 872.440565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BLqLf5MCgx6 |
|---|---|
| Name | BALIBALOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H68O18 |
| InChI | InChI=1S/C43H68O18/c1-23(2)9-5-14-26(15-7-12-24(3)10-6-11-25(4)13-8-16-27-17-31(47)55-22-27)21-56-42-39(36(52)33(49)29(19-45)58-42)61-43-40(37(53)34(50)30(20-46)59-43)60-41-38(54)35(51)32(48)28(18-44)57-41/h9-10,13,15,17,28-30,32-46,48-54H,5-8,11-12,14,16,18-22H2,1-4H3/b24-10+,25-13+,26-15-/t28-,29+,30-,32-,33+,34-,35+,36-,37+,38-,39+,40-,41+,42+,43+/m1/s1 |
| InChIKey | QHEBCCVHGGITAV-DSUQVKGJSA-N |
| Literature Reference Author | C.AUDOIN,D.BONHOMME,J.IVANISEVIC,M.DELACRUZ,B.CAUTAIN,M.C.MO NTEIRO,F.REYES,L.RIO |
| Literature Reference Citation | MAR.DRUGS,11,1477(2013) |
| Literature Reference DOI | 10.3390/md11051477 |
| Molecular Weight | 873.002 g/mol |
| Source File Reference | UWLU74824 |