| SpectraBase Compound ID | 1JQvdcL4ikj |
|---|---|
| InChI | InChI=1S/C85H132O48/c1-15-30-53(31-28-26-24-22-20-18-16-17-19-21-23-25-27-29-32-108-34-60(79(106)107)114-45(7)92)122-81-72(132-84-76(120-51(13)98)73(117-48(10)95)68(115-46(8)93)57(126-84)37-111-42(4)89)66(105)67(54(33-86)123-81)129-83-77(121-52(14)99)75(119-50(12)97)70(59(128-83)39-113-44(6)91)130-85-78(74(118-49(11)96)69(116-47(9)94)58(127-85)38-112-43(5)90)133-82-71(64(103)62(101)56(125-82)36-110-41(3)88)131-80-65(104)63(102)61(100)55(124-80)35-109-40(2)87/h53-78,80-86,100-105H,15-39H2,1-14H3,(H,106,107)/t53-,54+,55+,56+,57+,58+,59+,60-,61+,62+,63-,64-,65+,66-,67+,68+,69+,70+,71+,72+,73-,74-,75-,76+,77+,78+,80-,81+,82-,83-,84-,85-/m1/s1 |
| InChIKey | FPNUFLLDEBJXMU-NHQFPYFASA-N |
| Mol Weight | 1921.9 g/mol |
| Molecular Formula | C85H132O48 |
| Exact Mass | 1920.788806 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LnsTp4qc70i |
|---|---|
| Name | AGMINOSIDE_A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C85H132O48 |
| InChI | InChI=1S/C85H132O48/c1-15-30-53(31-28-26-24-22-20-18-16-17-19-21-23-25-27-29-32-108-34-60(79(106)107)114-45(7)92)122-81-72(132-84-76(120-51(13)98)73(117-48(10)95)68(115-46(8)93)57(126-84)37-111-42(4)89)66(105)67(54(33-86)123-81)129-83-77(121-52(14)99)75(119-50(12)97)70(59(128-83)39-113-44(6)91)130-85-78(74(118-49(11)96)69(116-47(9)94)58(127-85)38-112-43(5)90)133-82-71(64(103)62(101)56(125-82)36-110-41(3)88)131-80-65(104)63(102)61(100)55(124-80)35-109-40(2)87/h53-78,80-86,100-105H,15-39H2,1-14H3,(H,106,107)/t53-,54+,55+,56+,57+,58+,59+,60-,61+,62+,63-,64-,65+,66-,67+,68+,69+,70+,71+,72+,73-,74-,75-,76+,77+,78+,80-,81+,82-,83-,84-,85-/m1/s1 |
| InChIKey | FPNUFLLDEBJXMU-NHQFPYFASA-N |
| Literature Reference Author | J.M.WOJNAR,P.T.NORTHCOTE |
| Literature Reference Citation | J.NAT.PROD.,74,69(2011) |
| Literature Reference DOI | 10.1021/np100710c |
| Molecular Weight | 1921.954 g/mol |
| Sample ID | 37677 |
| Solvent | CD3OD |