| SpectraBase Compound ID | 9LkPTLaU3WV |
|---|---|
| InChI | InChI=1S/C91H98O18/c1-56(2)65-46-51-91(55-100-85-76(108-83(97)63-40-26-14-27-41-63)75(107-82(96)62-38-24-13-25-39-62)73(105-80(94)60-34-20-11-21-35-60)67(102-85)54-99-78(92)58-30-16-9-17-31-58)53-52-89(7)66(71(65)91)44-45-69-88(6)49-48-70(87(4,5)68(88)47-50-90(69,89)8)103-86-77(109-84(98)64-42-28-15-29-43-64)74(106-81(95)61-36-22-12-23-37-61)72(57(3)101-86)104-79(93)59-32-18-10-19-33-59/h9-43,57,65-77,85-86H,1,44-55H2,2-8H3/t57-,65-,66+,67+,68-,69+,70-,71+,72-,73+,74+,75-,76+,77+,85+,86-,88-,89+,90+,91+/m0/s1 |
| InChIKey | WNJVFPLMMWDHDT-MUPFVLHCSA-N |
| Mol Weight | 1479.8 g/mol |
| Molecular Formula | C91H98O18 |
| Exact Mass | 1478.675316 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3v2s8lEueSi |
|---|---|
| Name | 28-O-2,3,4,6-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSYLBETULIN_3-BETA-O-2,3,4-TRI-O-BENZOYL-ALPHA-L-RHAMNOPYRANOSIDE |
| Compound Number | 10B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C91H98O18 |
| InChI | InChI=1S/C91H98O18/c1-56(2)65-46-51-91(55-100-85-76(108-83(97)63-40-26-14-27-41-63)75(107-82(96)62-38-24-13-25-39-62)73(105-80(94)60-34-20-11-21-35-60)67(102-85)54-99-78(92)58-30-16-9-17-31-58)53-52-89(7)66(71(65)91)44-45-69-88(6)49-48-70(87(4,5)68(88)47-50-90(69,89)8)103-86-77(109-84(98)64-42-28-15-29-43-64)74(106-81(95)61-36-22-12-23-37-61)72(57(3)101-86)104-79(93)59-32-18-10-19-33-59/h9-43,57,65-77,85-86H,1,44-55H2,2-8H3/t57-,65-,66+,67+,68-,69+,70-,71+,72-,73+,74+,75-,76+,77+,85+,86-,88-,89+,90+,91+/m0/s1 |
| InChIKey | WNJVFPLMMWDHDT-MUPFVLHCSA-N |
| Literature Reference Author | C.GAUTHIER,J.LEGAULT,S.LAVOIE,S.RONDEAU,S.TREMBLAY,A.PICHETT E |
| Literature Reference Citation | J.NAT.PROD.,72,72(2009) |
| Literature Reference DOI | 10.1021/np800579x |
| Molecular Weight | 1479.768 g/mol |
| Sample ID | 32006 |
| Solvent | CDCl3 |