SpectraBase Compound ID | 1tLdguNWJ2X |
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InChI | InChI=1S/C34H39ClO18/c1-14(36)43-12-23-27(46-16(3)38)28(47-17(4)39)29(48-18(5)40)33(49-23)52-32-25-22-11-24(50-32)44-13-34(25,53-19(6)41)30(35)26(22)51-31(42)20-7-9-21(10-8-20)45-15(2)37/h7-10,22-30,32-33H,11-13H2,1-6H3/t22-,23+,24-,25-,26+,27+,28-,29+,30-,32+,33-,34-/m1/s1 |
InChIKey | GWVXULUOXLWLFL-KAODXQNXSA-N |
Mol Weight | 771.1 g/mol |
Molecular Formula | C34H39ClO18 |
Exact Mass | 770.182492 g/mol |
SpectraBase Spectrum ID | BSOthPAhvG9 |
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Name | 6-O-PARA-HYDROXYBENZOYL-GLUTINOSIDE-HEXAACETATE |
Compound Number | 3A |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C34H39ClO18 |
InChI | InChI=1S/C34H39ClO18/c1-14(36)43-12-23-27(46-16(3)38)28(47-17(4)39)29(48-18(5)40)33(49-23)52-32-25-22-11-24(50-32)44-13-34(25,53-19(6)41)30(35)26(22)51-31(42)20-7-9-21(10-8-20)45-15(2)37/h7-10,22-30,32-33H,11-13H2,1-6H3/t22-,23+,24-,25-,26+,27+,28-,29+,30-,32+,33-,34-/m1/s1 |
InChIKey | GWVXULUOXLWLFL-KAODXQNXSA-N |
Literature Reference Citation | CHEM.PHARM.BULL.,46,1056(1998) |
Literature Reference DOI | 10.1248/cpb.46.1056 |
Molecular Weight | 771.126 g/mol |
Solvent | CDCl3 |
Source File Reference | UWMS6562 |