SpectraBase Compound ID | 2l6tCz1mXWd |
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InChI | InChI=1S/C47H56O26/c1-16-28(51)33(56)36(59)44(65-16)64-15-26-31(54)35(58)42(73-45-37(60)34(57)30(53)25(14-48)69-45)47(70-26)72-41-32(55)27-22(50)12-20(13-24(27)68-39(41)18-8-10-19(49)11-9-18)67-46-38(61)40(29(52)17(2)66-46)71-43(62)21-6-4-5-7-23(21)63-3/h4-13,16-17,25-26,28-31,33-38,40,42,44-54,56-61H,14-15H2,1-3H3/t16-,17+,25+,26+,28-,29+,30+,31-,33+,34-,35-,36+,37+,38-,40-,42+,44+,45-,46+,47-/m1/s1 |
InChIKey | QTJCVGUOWJYLGH-DTCGNLMISA-N |
Mol Weight | 1036.9 g/mol |
Molecular Formula | C47H56O26 |
Exact Mass | 1036.305982 g/mol |
SpectraBase Spectrum ID | 8mRho5o5ONq |
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Name | GLADIATOSIDE-A2;7-O-(3-O-ORTHO-ANISOYL)-ALPHA-L-RHAMNOPYRANOSYL-KAEMPFEROL-3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)]-BETA |
Compound Number | 4 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C47H56O26 |
InChI | InChI=1S/C47H56O26/c1-16-28(51)33(56)36(59)44(65-16)64-15-26-31(54)35(58)42(73-45-37(60)34(57)30(53)25(14-48)69-45)47(70-26)72-41-32(55)27-22(50)12-20(13-24(27)68-39(41)18-8-10-19(49)11-9-18)67-46-38(61)40(29(52)17(2)66-46)71-43(62)21-6-4-5-7-23(21)63-3/h4-13,16-17,25-26,28-31,33-38,40,42,44-54,56-61H,14-15H2,1-3H3/t16-,17+,25+,26+,28-,29+,30+,31-,33+,34-,35-,36+,37+,38-,40-,42+,44+,45-,46+,47-/m1/s1 |
InChIKey | QTJCVGUOWJYLGH-DTCGNLMISA-N |
Literature Reference Author | T.MURAKAMI,K.KOHNO,A.KISHI,H.MATSUDA,M.YOSHIKAWA |
Literature Reference Citation | CHEM.PHARM.BULL.,48,1673(2000) |
Literature Reference DOI | 10.1248/cpb.48.1673 |
Molecular Weight | 1036.946 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWVN4653 |