| SpectraBase Compound ID | DZxLLXYzX9T |
|---|---|
| InChI | InChI=1S/C52H82O22/c1-47(2)14-16-52(46(66)74-44-36(62)33(59)32(58)26(19-53)69-44)17-15-50(6)22(23(52)18-47)8-9-28-49(5)12-11-29(48(3,4)27(49)10-13-51(28,50)7)70-45-40(73-43-35(61)31(57)25(55)21-68-43)38(37(63)39(72-45)41(64)65)71-42-34(60)30(56)24(54)20-67-42/h8,23-40,42-45,53-63H,9-21H2,1-7H3,(H,64,65)/t23?,24?,25-,26+,27?,28?,29?,30?,31+,32-,33-,34?,35+,36+,37?,38?,39?,40?,42?,43-,44+,45?,49?,50?,51?,52?/m0/s1 |
| InChIKey | JGWOUOSRJOOXAL-RBLKGXHMSA-N |
| Mol Weight | 1059.2 g/mol |
| Molecular Formula | C52H82O22 |
| Exact Mass | 1058.529774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gfh4M6Yj3g3 |
|---|---|
| Name | Hemsloside-ma2 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C52H82O22 |
| InChI | InChI=1S/C52H82O22/c1-47(2)14-16-52(46(66)74-44-36(62)33(59)32(58)26(19-53)69-44)17-15-50(6)22(23(52)18-47)8-9-28-49(5)12-11-29(48(3,4)27(49)10-13-51(28,50)7)70-45-40(73-43-35(61)31(57)25(55)21-68-43)38(37(63)39(72-45)41(64)65)71-42-34(60)30(56)24(54)20-67-42/h8,23-40,42-45,53-63H,9-21H2,1-7H3,(H,64,65)/t23?,24?,25-,26+,27?,28?,29?,30?,31+,32-,33-,34?,35+,36+,37?,38?,39?,40?,42?,43-,44+,45?,49?,50?,51?,52?/m0/s1 |
| InChIKey | JGWOUOSRJOOXAL-RBLKGXHMSA-N |
| Instrument Name | Jeol PFT-100 |
| Literature Reference | R.L. Nie, T. Morita, Planta Medica 50, 322 (1984). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Pyridine-D5 |