SpectraBase Compound ID | GczNAdyQtLs |
---|---|
InChI | InChI=1S/C54H88O23/c1-23-33(60)43(76-47-42(69)39(66)36(63)28(74-47)20-70-45-40(67)37(64)34(61)26(18-55)72-45)44(77-46-41(68)38(65)35(62)27(19-56)73-46)48(71-23)75-32-11-12-50(4)29(51(32,5)21-57)10-13-52(6)30(50)9-8-24-25-16-49(2,3)14-15-54(25,22-58)31(59)17-53(24,52)7/h8-9,23,25-29,31-48,55-69H,10-22H2,1-7H3/t23-,25-,26-,27+,28-,29+,31-,32-,33+,34-,35+,36-,37+,38-,39+,40-,41+,42-,43+,44-,45-,46-,47+,48+,50-,51-,52+,53+,54+/m0/s1 |
InChIKey | KCTZCRYPVMTUCC-ZAVBSWFQSA-N |
Mol Weight | 1105.3 g/mol |
Molecular Formula | C54H88O23 |
Exact Mass | 1104.571639 g/mol |
Enantiomer InChIKey | KCTZCRYPVMTUCC-HBEIEWHPSA-N |
Title | Journal or Book | Year |
---|---|---|
Chemical Constituents fromClinopodium Urticifolium | Journal of the Chinese Chemical Society | 2004 |
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