| SpectraBase Compound ID | AYmgUTCsuqj |
|---|---|
| InChI | InChI=1S/C71H112O31/c1-16-20-21-22-23-26-29-35-50(36-30-27-24-25-28-34-39(5)72)95-70-66(62(92-47(13)78)58(90-45(11)76)51(96-70)37-84-42(8)73)102-71-67(101-69-65(94-49(15)80)61(99-54(82)32-18-3)57(41(7)87-69)89-44(10)75)63(100-55(83)33-19-4)59(98-53(81)31-17-2)52(97-71)38-85-68-64(93-48(14)79)60(91-46(12)77)56(40(6)86-68)88-43(9)74/h40-41,50-52,56-71H,16-38H2,1-15H3/t40-,41+,50-,51+,52+,56+,57+,58+,59+,60+,61-,62-,63-,64+,65+,66+,67+,68-,69+,70+,71-/m1/s1 |
| InChIKey | NKNVIZOYCXKOCQ-BLXPWXBSSA-N |
| Mol Weight | 1461.6 g/mol |
| Molecular Formula | C71H112O31 |
| Exact Mass | 1460.718757 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Eh0ymlhXWCT |
|---|---|
| Name | CAMINOSIDE_C_PERACETATE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C71H112O31 |
| InChI | InChI=1S/C71H112O31/c1-16-20-21-22-23-26-29-35-50(36-30-27-24-25-28-34-39(5)72)95-70-66(62(92-47(13)78)58(90-45(11)76)51(96-70)37-84-42(8)73)102-71-67(101-69-65(94-49(15)80)61(99-54(82)32-18-3)57(41(7)87-69)89-44(10)75)63(100-55(83)33-19-4)59(98-53(81)31-17-2)52(97-71)38-85-68-64(93-48(14)79)60(91-46(12)77)56(40(6)86-68)88-43(9)74/h40-41,50-52,56-71H,16-38H2,1-15H3/t40-,41+,50-,51+,52+,56+,57+,58+,59+,60+,61-,62-,63-,64+,65+,66+,67+,68-,69+,70+,71-/m1/s1 |
| InChIKey | NKNVIZOYCXKOCQ-BLXPWXBSSA-N |
| Literature Reference Author | R.G.LININGTON,M.ROBERTSON,A.GAUTHIER,B.B.FINLAY,J.B.MACMILLA N,T.F.MOLINSKI,R.VAN |
| Literature Reference Citation | J.NAT.PROD.,69,173(2006) |
| Literature Reference DOI | 10.1021/np050192h |
| Molecular Weight | 1461.652 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWMZ18016 |