![28-O-[GLUCOPYRANOSYL-(1->3)-XYLOPYRANOSYL]-ECHINOCYSTIC-ACID-ESTER](/api/spectrum/CPSJCCaVyIU/structure.png?h=300&w=458 "28-O-[GLUCOPYRANOSYL-(1->3)-XYLOPYRANOSYL]-ECHINOCYSTIC-ACID-ESTER")
| SpectraBase Compound ID | 6VSIZcs2sAx |
|---|---|
| InChI | InChI=1S/C41H66O13/c1-36(2)14-15-41(35(50)54-33-31(49)32(22(43)19-51-33)53-34-30(48)29(47)28(46)23(18-42)52-34)21(16-36)20-8-9-25-38(5)12-11-26(44)37(3,4)24(38)10-13-39(25,6)40(20,7)17-27(41)45/h8,21-34,42-49H,9-19H2,1-7H3/t21?,22-,23-,24?,25?,26+,27-,28-,29+,30-,31-,32+,33+,34+,38+,39-,40-,41-/m1/s1 |
| InChIKey | FGEYPUPTVCFCPQ-WVPPGPJYSA-N |
| Mol Weight | 767.0 g/mol |
| Molecular Formula | C41H66O13 |
| Exact Mass | 766.450342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CPSJCCaVyIU |
|---|---|
| Name | 28-O-[GLUCOPYRANOSYL-(1->3)-XYLOPYRANOSYL]-ECHINOCYSTIC-ACID-ESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H66O13 |
| InChI | InChI=1S/C41H66O13/c1-36(2)14-15-41(35(50)54-33-31(49)32(22(43)19-51-33)53-34-30(48)29(47)28(46)23(18-42)52-34)21(16-36)20-8-9-25-38(5)12-11-26(44)37(3,4)24(38)10-13-39(25,6)40(20,7)17-27(41)45/h8,21-34,42-49H,9-19H2,1-7H3/t21?,22-,23-,24?,25?,26+,27-,28-,29+,30-,31-,32+,33+,34+,38+,39-,40-,41-/m1/s1 |
| InChIKey | FGEYPUPTVCFCPQ-WVPPGPJYSA-N |
| Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
| Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
| Molecular Weight | 766.967 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1039 |