SpectraBase Compound ID | 1j3kyFn1R67 |
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InChI | InChI=1S/C41H52O21/c1-15(2)6-11-20-22(57-39-32(51)30(49)27(46)23(13-42)58-39)12-21(44)25-29(48)38(35(60-36(20)25)18-7-9-19(54-5)10-8-18)62-41-34(53)37(26(45)16(3)56-41)61-40-33(52)31(50)28(47)24(59-40)14-55-17(4)43/h6-10,12,16,23-24,26-28,30-34,37,39-42,44-47,49-53H,11,13-14H2,1-5H3/t16-,23-,24+,26-,27-,28-,30+,31-,32-,33+,34+,37+,39-,40-,41-/m1/s1 |
InChIKey | SCGIMZSPRPPEMA-KDGONBLXSA-N |
Mol Weight | 880.8 g/mol |
Molecular Formula | C41H52O21 |
Exact Mass | 880.300109 g/mol |
SpectraBase Spectrum ID | LcZwEZLn54t |
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Name | ANHYDROICARITIN-3-O-[6-O-ACETYL-BETA-D-GALACTOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C41H52O21 |
InChI | InChI=1S/C41H52O21/c1-15(2)6-11-20-22(57-39-32(51)30(49)27(46)23(13-42)58-39)12-21(44)25-29(48)38(35(60-36(20)25)18-7-9-19(54-5)10-8-18)62-41-34(53)37(26(45)16(3)56-41)61-40-33(52)31(50)28(47)24(59-40)14-55-17(4)43/h6-10,12,16,23-24,26-28,30-34,37,39-42,44-47,49-53H,11,13-14H2,1-5H3/t16-,23-,24+,26-,27-,28-,30+,31-,32-,33+,34+,37+,39-,40-,41-/m1/s1 |
InChIKey | SCGIMZSPRPPEMA-KDGONBLXSA-N |
Literature Reference Author | M.MIZUNO,M.IINUMA,T.TANAKA,N.SAKAKIBARA,J.MURATA,H.MURATA,F. A.LANG |
Literature Reference Citation | PHYTOCHEM.,29,1277(1990) |
Literature Reference DOI | 10.1016/0031-9422(90)85442-I |
Molecular Weight | 880.851 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWVN29594 |