| SpectraBase Compound ID | GMjcscfZXQb |
|---|---|
| InChI | InChI=1S/C39H48O16/c1-9-24(41)50-29-38(45)28(51-30(44)33(6)19(2)52-33)32(5)17-37(38)35(18-48-26(43)14-22(32)35)36-12-11-31(4,27(49-20(3)40)21-10-13-47-16-21)23(15-25(42)46-8)39(29,36)55-34(7,53-36)54-37/h10,13,16,19,22-23,27-29,45H,9,11-12,14-15,17-18H2,1-8H3/t19-,22+,23-,27+,28+,29-,31-,32+,33+,34-,35+,36+,37-,38+,39-/m1/s1 |
| InChIKey | PSIAPSWMYWLEHN-VAEFTEMNSA-N |
| Mol Weight | 772.8 g/mol |
| Molecular Formula | C39H48O16 |
| Exact Mass | 772.294235 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 | 9aBegZS7Yam |
|---|---|
| Name | SWIETENITIN_D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H48O16 |
| InChI | InChI=1S/C39H48O16/c1-9-24(41)50-29-38(45)28(51-30(44)33(6)19(2)52-33)32(5)17-37(38)35(18-48-26(43)14-22(32)35)36-12-11-31(4,27(49-20(3)40)21-10-13-47-16-21)23(15-25(42)46-8)39(29,36)55-34(7,53-36)54-37/h10,13,16,19,22-23,27-29,45H,9,11-12,14-15,17-18H2,1-8H3/t19-,22+,23-,27+,28+,29-,31-,32+,33+,34-,35+,36+,37-,38+,39-/m1/s1 |
| InChIKey | PSIAPSWMYWLEHN-VAEFTEMNSA-N |
| Literature Reference Author | B.D.LIN,C.R.ZHANG,S.P.YANG,S.ZHANG,Y.WU,J.M.YUE |
| Literature Reference Citation | J.NAT.PROD.,72,1305(2009) |
| Literature Reference DOI | 10.1021/np900139c |
| Molecular Weight | 772.801 g/mol |
| Sample ID | 33213 |
| Solvent | CDCl3 |