SpectraBase Compound ID | Iq8eWACVHm3 |
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InChI | InChI=1S/C39H64O13/c1-17-8-11-39(47-16-17)18(2)28-26(52-39)13-23-21-7-6-20-12-25(24(41)14-38(20,5)22(21)9-10-37(23,28)4)49-36-34(32(45)30(43)27(15-40)50-36)51-35-33(46)31(44)29(42)19(3)48-35/h17-36,40-46H,6-16H2,1-5H3/t17-,18-,19+,20-,21?,22?,23?,24+,25+,26?,27-,28?,29+,30+,31-,32+,33-,34-,35+,36-,37-,38-,39+/m0/s1 |
InChIKey | KHIZMXXBPIYCQP-OUARLYBESA-N |
Mol Weight | 740.9 g/mol |
Molecular Formula | C39H64O13 |
Exact Mass | 740.434692 g/mol |
SpectraBase Spectrum ID | 7OGM6nUKaBD |
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Name | GITOGENIN-3-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSIDE] |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C39H64O13 |
InChI | InChI=1S/C39H64O13/c1-17-8-11-39(47-16-17)18(2)28-26(52-39)13-23-21-7-6-20-12-25(24(41)14-38(20,5)22(21)9-10-37(23,28)4)49-36-34(32(45)30(43)27(15-40)50-36)51-35-33(46)31(44)29(42)19(3)48-35/h17-36,40-46H,6-16H2,1-5H3/t17-,18-,19+,20-,21?,22?,23?,24+,25+,26?,27-,28?,29+,30+,31-,32+,33-,34-,35+,36-,37-,38-,39+/m0/s1 |
InChIKey | KHIZMXXBPIYCQP-OUARLYBESA-N |
Literature Reference Author | Y.MIMAKI,T.KANMOTO,M.KURODA,Y.SASHIDA,Y.SATOMI,A.NISHINO,H.N ISHINO |
Literature Reference Citation | PHYTOCHEM.,42,1065(1996) |
Literature Reference DOI | 10.1016/0031-9422(96)00030-1 |
Molecular Weight | 740.929 g/mol |
Solvent | C5D5N |
Source File Reference | UWVN2926 |