| SpectraBase Compound ID | IDWu8B2LAPm |
|---|---|
| InChI | InChI=1S/C57H92O26/c1-22-43(80-47-40(70)34(64)27(60)19-75-47)38(68)42(72)48(78-22)81-44-35(65)28(61)20-76-50(44)83-51(73)57-14-13-52(2,3)15-24(57)23-9-10-31-54(6)16-25(58)45(53(4,5)30(54)11-12-55(31,7)56(23,8)17-32(57)62)82-49-41(71)37(67)36(66)29(79-49)21-77-46-39(69)33(63)26(59)18-74-46/h9,22,24-50,58-72H,10-21H2,1-8H3/t22-,24?,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-,54-,55+,56+,57+/m1/s1 |
| InChIKey | ZYHIYHSCULYHBI-SXKOXJDSSA-N |
| Mol Weight | 1193.3 g/mol |
| Molecular Formula | C57H92O26 |
| Exact Mass | 1192.587683 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Xgj8KDENmb |
|---|---|
| Name | ASTER SAPONIN G ; 3-O-(O-A-L-ARABINOPYRANOSYL-(1->6)-B-D-GLUCOPYRANOSYL)ASTEROGENIC ACID 28-(O-B-D-XYLOPYRANOSYL-(1->4)-A-L-RHAMNOPYRANOSYL-(1->2)-B-D-XYLOPYRANOSYL)ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C57H92O26 |
| InChI | InChI=1S/C57H92O26/c1-22-43(80-47-40(70)34(64)27(60)19-75-47)38(68)42(72)48(78-22)81-44-35(65)28(61)20-76-50(44)83-51(73)57-14-13-52(2,3)15-24(57)23-9-10-31-54(6)16-25(58)45(53(4,5)30(54)11-12-55(31,7)56(23,8)17-32(57)62)82-49-41(71)37(67)36(66)29(79-49)21-77-46-39(69)33(63)26(59)18-74-46/h9,22,24-50,58-72H,10-21H2,1-8H3/t22-,24?,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-,54-,55+,56+,57+/m1/s1 |
| InChIKey | ZYHIYHSCULYHBI-SXKOXJDSSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |