SpectraBase Compound ID | 9s6270MSvnG |
---|---|
InChI | InChI=1S/C48H78O16/c1-22-30(51)32(53)35(56)40(60-22)63-37-31(52)25(49)21-59-41(37)64-38-34(55)33(54)36(39(57)58-10)62-42(38)61-29-14-15-46(7)26(44(29,4)5)13-16-48(9)27(46)12-11-23-24-19-43(2,3)20-28(50)45(24,6)17-18-47(23,48)8/h11,22,24-38,40-42,49-56H,12-21H2,1-10H3/t22-,24-,25-,26?,27?,28+,29-,30-,31-,32+,33-,34-,35+,36-,37+,38+,40-,41-,42+,45+,46-,47+,48+/m0/s1 |
InChIKey | SHYOYCFMMJYBKR-RGCHTQORSA-N |
Mol Weight | 911.1 g/mol |
Molecular Formula | C48H78O16 |
Exact Mass | 910.528986 g/mol |
SpectraBase Spectrum ID | 8iZhBQ6b3J9 |
---|---|
Name | 3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYLMETHYLESTER]-SOPHORODIOL |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C48H78O16 |
InChI | InChI=1S/C48H78O16/c1-22-30(51)32(53)35(56)40(60-22)63-37-31(52)25(49)21-59-41(37)64-38-34(55)33(54)36(39(57)58-10)62-42(38)61-29-14-15-46(7)26(44(29,4)5)13-16-48(9)27(46)12-11-23-24-19-43(2,3)20-28(50)45(24,6)17-18-47(23,48)8/h11,22,24-38,40-42,49-56H,12-21H2,1-10H3/t22-,24-,25-,26?,27?,28+,29-,30-,31-,32+,33-,34-,35+,36-,37+,38+,40-,41-,42+,45+,46-,47+,48+/m0/s1 |
InChIKey | SHYOYCFMMJYBKR-RGCHTQORSA-N |
Literature Reference Author | J.-E.KINJO,T.TAKESHITA,Y.ABE,N.TERADA,H.YAMASHITA,M.YAMASAKI ,K.TAKEUCHI,K.MURAKA |
Literature Reference Citation | CHEM.PHARM.BULL.,36,1174(1988) |
Literature Reference DOI | 10.1248/cpb.36.1174 |
Molecular Weight | 911.138 g/mol |
Solvent | PYRIDINE-D5 |
Source File Reference | UWBK45 |