SpectraBase Compound ID | 9DQGmaw4iK7 |
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InChI | InChI=1S/C48H56O26/c1-16-30(54)35(59)38(62)45(66-16)65-15-27-33(57)42(72-28(53)11-6-19-4-8-21(49)9-5-19)44(74-47-40(64)37(61)32(56)18(3)68-47)48(71-27)73-43-34(58)29-25(52)13-22(69-46-39(63)36(60)31(55)17(2)67-46)14-26(29)70-41(43)20-7-10-23(50)24(51)12-20/h4-14,16-18,27,30-33,35-40,42,44-52,54-57,59-64H,15H2,1-3H3/b11-6+/t16-,17+,18-,27-,30-,31+,32-,33+,35+,36-,37+,38+,39-,40+,42+,44-,45+,46-,47-,48+/m1/s1 |
InChIKey | TUPGAGLJIIHDNH-PNIBFLALSA-N |
Mol Weight | 1048.9 g/mol |
Molecular Formula | C48H56O26 |
Exact Mass | 1048.305982 g/mol |
SpectraBase Spectrum ID | 2tuhAhMla32 |
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Name | QUERCETIN-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->6)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-(3-O-TRANS-P-COUMAROYL)-BETA-D-GALACTOPYRANOSIDE-7-O-ALPHA-L-RHAMNOPY |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C48H56O26 |
InChI | InChI=1S/C48H56O26/c1-16-30(54)35(59)38(62)45(66-16)65-15-27-33(57)42(72-28(53)11-6-19-4-8-21(49)9-5-19)44(74-47-40(64)37(61)32(56)18(3)68-47)48(71-27)73-43-34(58)29-25(52)13-22(69-46-39(63)36(60)31(55)17(2)67-46)14-26(29)70-41(43)20-7-10-23(50)24(51)12-20/h4-14,16-18,27,30-33,35-40,42,44-52,54-57,59-64H,15H2,1-3H3/b11-6+/t16-,17+,18-,27-,30-,31+,32-,33+,35+,36-,37+,38+,39-,40+,42+,44-,45+,46-,47-,48+/m1/s1 |
InChIKey | TUPGAGLJIIHDNH-PNIBFLALSA-N |
Literature Reference Author | A.ITOH,T.KUMASHIRO,T.TANAHASHI,N.NAGAKURA,T.NISHI |
Literature Reference Citation | J.NAT.PROD.,65,352(2002) |
Literature Reference DOI | 10.1021/np010518w |
Molecular Weight | 1048.957 g/mol |
Solvent | CD3OD |
Source File Reference | UWSI4063 |