| SpectraBase Compound ID | EqfNGsTvXAQ |
|---|---|
| InChI | InChI=1S/C61H86O34/c1-8-26-29(33(53(78)81-5)21-86-56(26)93-59-50(75)47(72)44(69)37(16-63)90-59)12-40(66)84-19-25(15-62)43-32(20-85-41(67)13-30-27(9-2)57(87-22-34(30)54(79)82-6)94-60-51(76)48(73)45(70)38(17-64)91-60)24(4)11-36(43)89-42(68)14-31-28(10-3)58(88-23-35(31)55(80)83-7)95-61-52(77)49(74)46(71)39(18-65)92-61/h8-10,21-25,29-32,36-39,43-52,56-65,69-77H,11-20H2,1-7H3/b26-8-,27-9-,28-10-/t24-,25?,29-,30-,31-,32+,36-,37-,38-,39-,43-,44-,45-,46-,47+,48+,49+,50-,51-,52-,56-,57-,58-,59+,60+,61+/m0/s1 |
| InChIKey | UJBGOJBICNWSIL-FEKCXNLVSA-N |
| Mol Weight | 1363.3 g/mol |
| Molecular Formula | C61H86O34 |
| Exact Mass | 1362.50005 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JO0DACX4H5t |
|---|---|
| Name | CRAIGOSIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C61H86O34 |
| InChI | InChI=1S/C61H86O34/c1-8-26-29(33(53(78)81-5)21-86-56(26)93-59-50(75)47(72)44(69)37(16-63)90-59)12-40(66)84-19-25(15-62)43-32(20-85-41(67)13-30-27(9-2)57(87-22-34(30)54(79)82-6)94-60-51(76)48(73)45(70)38(17-64)91-60)24(4)11-36(43)89-42(68)14-31-28(10-3)58(88-23-35(31)55(80)83-7)95-61-52(77)49(74)46(71)39(18-65)92-61/h8-10,21-25,29-32,36-39,43-52,56-65,69-77H,11-20H2,1-7H3/b26-8-,27-9-,28-10-/t24-,25?,29-,30-,31-,32+,36-,37-,38-,39-,43-,44-,45-,46-,47+,48+,49+,50-,51-,52-,56-,57-,58-,59+,60+,61+/m0/s1 |
| InChIKey | UJBGOJBICNWSIL-FEKCXNLVSA-N |
| Literature Reference Author | F.R.GALLO,G.PALAZZINO,E.FEDERICI,R.IURILLI,F.D.MONACHE,K.CHI FUNDERA,C.GALEFFI |
| Literature Reference Citation | PHYTOCHEM.,67,504(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.11.007 |
| Molecular Weight | 1363.333 g/mol |
| Sample ID | 66098 |
| Solvent | CD3OD |