| SpectraBase Compound ID | DbLvceUjf3R |
|---|---|
| InChI | InChI=1S/C37H50O21/c1-50-20-7-4-17(11-19(20)42)9-10-52-35-31(49)33(32(24(15-40)55-35)56-25(43)8-5-16-3-6-18(41)21(12-16)51-2)57-37-34(29(47)27(45)23(14-39)54-37)58-36-30(48)28(46)26(44)22(13-38)53-36/h3-8,11-12,22-24,26-42,44-49H,9-10,13-15H2,1-2H3/b8-5+/t22-,23-,24+,26-,27-,28+,29+,30-,31+,32+,33+,34-,35+,36+,37+/m1/s1 |
| InChIKey | XFAHTHMYMDTOTE-DSJMSTFWSA-N |
| Mol Weight | 830.8 g/mol |
| Molecular Formula | C37H50O21 |
| Exact Mass | 830.284459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DARL5YDtAB |
|---|---|
| Name | SCROSIDE-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H50O21 |
| InChI | InChI=1S/C37H50O21/c1-50-20-7-4-17(11-19(20)42)9-10-52-35-31(49)33(32(24(15-40)55-35)56-25(43)8-5-16-3-6-18(41)21(12-16)51-2)57-37-34(29(47)27(45)23(14-39)54-37)58-36-30(48)28(46)26(44)22(13-38)53-36/h3-8,11-12,22-24,26-42,44-49H,9-10,13-15H2,1-2H3/b8-5+/t22-,23-,24+,26-,27-,28+,29+,30-,31+,32+,33+,34-,35+,36+,37+/m1/s1 |
| InChIKey | XFAHTHMYMDTOTE-DSJMSTFWSA-N |
| Literature Reference Author | J.X.LI,P.LI,Y.TEZUKA,T.NAMBA,S.KADOTA |
| Literature Reference Citation | PHYTOCHEM.,48,537(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00030-2 |
| Molecular Weight | 830.791 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS1078 |