SpectraBase Compound ID | 4ai5oz1S5iK |
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InChI | InChI=1S/C42H68O15/c1-20-9-14-42(36(52)57-35-32(51)30(49)28(47)23(18-44)55-35)16-15-39(4)21(33(42)41(20,6)53)7-8-25-37(2)12-11-26(38(3,19-45)24(37)10-13-40(25,39)5)56-34-31(50)29(48)27(46)22(17-43)54-34/h7,20,22-35,43-51,53H,8-19H2,1-6H3/t20-,22-,23-,24?,25?,26+,27-,28-,29+,30+,31-,32-,33?,34+,35+,37+,38-,39-,40-,41-,42+/m0/s1 |
InChIKey | BTGWDXCTCFDPBM-VZSZZHEFSA-N |
Mol Weight | 813.0 g/mol |
Molecular Formula | C42H68O15 |
Exact Mass | 812.455821 g/mol |
SpectraBase Spectrum ID | 7yDqSCxgE5p |
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Name | ILEXOSIDE XXXVI |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C42H68O15 |
InChI | InChI=1S/C42H68O15/c1-20-9-14-42(36(52)57-35-32(51)30(49)28(47)23(18-44)55-35)16-15-39(4)21(33(42)41(20,6)53)7-8-25-37(2)12-11-26(38(3,19-45)24(37)10-13-40(25,39)5)56-34-31(50)29(48)27(46)22(17-43)54-34/h7,20,22-35,43-51,53H,8-19H2,1-6H3/t20-,22-,23-,24?,25?,26+,27-,28-,29+,30+,31-,32-,33?,34+,35+,37+,38-,39-,40-,41-,42+/m0/s1 |
InChIKey | BTGWDXCTCFDPBM-VZSZZHEFSA-N |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |