SpectraBase Compound ID | 22PpYKoBgBM |
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InChI | InChI=1S/C38H48O20/c1-17(14-49-35(44)23-10-11-26(46-7)27(12-23)47-8)34(43)50-16-28-31(54-20(4)40)32(55-21(5)41)33(56-22(6)42)38(57-28)58-37-30-18(2)52-29(53-19(3)39)13-24(30)25(15-51-37)36(45)48-9/h10-12,15,17-18,24,28-33,37-38H,13-14,16H2,1-9H3/t17?,18-,24+,28+,29+,30+,31+,32-,33+,37-,38-/m0/s1 |
InChIKey | WPVTZRMUOUYLNA-YKUGBQEOSA-N |
Mol Weight | 824.8 g/mol |
Molecular Formula | C38H48O20 |
Exact Mass | 824.273894 g/mol |
SpectraBase Spectrum ID | EeERD11jbqA |
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Name | 6'-O-[(2R)-METHYL-3-VERATROYLOXYPROPANOYL]-MORRONISIDE-TETRAACETATE;[7-ALPHA-OAC] |
Compound Number | 5 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C38H48O20 |
InChI | InChI=1S/C38H48O20/c1-17(14-49-35(44)23-10-11-26(46-7)27(12-23)47-8)34(43)50-16-28-31(54-20(4)40)32(55-21(5)41)33(56-22(6)42)38(57-28)58-37-30-18(2)52-29(53-19(3)39)13-24(30)25(15-51-37)36(45)48-9/h10-12,15,17-18,24,28-33,37-38H,13-14,16H2,1-9H3/t17?,18-,24+,28+,29+,30+,31+,32-,33+,37-,38-/m0/s1 |
InChIKey | WPVTZRMUOUYLNA-YKUGBQEOSA-N |
Literature Reference Author | J.GARCIA,E.M.MPONDO,G.CARTIER,C.GEY |
Literature Reference Citation | J.NAT.PROD.,52,996(1989) |
Literature Reference DOI | 10.1021/np50065a013 |
Molecular Weight | 824.787 g/mol |
Solvent | CDCl3 |
Source File Reference | UWTS415 |