| SpectraBase Compound ID | 6Hq34S3EYPE |
|---|---|
| InChI | InChI=1S/C52H86O23/c1-21(20-67-46-41(63)39(61)35(57)30(17-53)70-46)9-14-52(66-6)22(2)33-29(75-52)16-28-26-8-7-24-15-25(10-12-50(24,4)27(26)11-13-51(28,33)5)69-49-45(74-47-42(64)38(60)34(56)23(3)68-47)44(37(59)32(19-55)72-49)73-48-43(65)40(62)36(58)31(18-54)71-48/h7,21-23,25-49,53-65H,8-20H2,1-6H3/t21-,22+,23+,25+,26?,27?,28?,29?,30-,31-,32-,33?,34+,35-,36-,37-,38-,39+,40+,41-,42-,43-,44+,45-,46-,47-,48+,49-,50+,51+,52?/m0/s1 |
| InChIKey | LOSNTJHBTWBJCC-LZJPOSLWSA-N |
| Mol Weight | 1079.2 g/mol |
| Molecular Formula | C52H86O23 |
| Exact Mass | 1078.555989 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CxfDReDgWdY |
|---|---|
| Name | TRIGOFOENOSIDE D-1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C52H86O23 |
| InChI | InChI=1S/C52H86O23/c1-21(20-67-46-41(63)39(61)35(57)30(17-53)70-46)9-14-52(66-6)22(2)33-29(75-52)16-28-26-8-7-24-15-25(10-12-50(24,4)27(26)11-13-51(28,33)5)69-49-45(74-47-42(64)38(60)34(56)23(3)68-47)44(37(59)32(19-55)72-49)73-48-43(65)40(62)36(58)31(18-54)71-48/h7,21-23,25-49,53-65H,8-20H2,1-6H3/t21-,22+,23+,25+,26?,27?,28?,29?,30-,31-,32-,33?,34+,35-,36-,37-,38-,39+,40+,41-,42-,43-,44+,45-,46-,47-,48+,49-,50+,51+,52?/m0/s1 |
| InChIKey | LOSNTJHBTWBJCC-LZJPOSLWSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |