| SpectraBase Compound ID | 4DyLYfxoGbF |
|---|---|
| InChI | InChI=1S/C68H92O23/c1-39(23-20-24-40(2)28-29-55-64(12,13)32-51(81-44(6)72)34-66(55,16)78)22-18-19-26-50(36-69)27-21-25-41(3)30-31-68-65(14,15)33-52(35-67(68,17)91-68)87-62-60(85-48(10)76)59(84-47(9)75)57(54(88-62)38-80-43(5)71)90-63-61(86-49(11)77)58(83-46(8)74)56(82-45(7)73)53(89-63)37-79-42(4)70/h18-28,36,51-54,56-63,78H,30-35,37-38H2,1-17H3/b19-18+,23-20+,27-21+,39-22+,40-24+,41-25+,50-26-/t29?,51-,52-,53+,54-,56-,57-,58-,59+,60-,61+,62-,63-,66+,67+,68-/m1/s1 |
| InChIKey | GZGKDSOONPINNS-SDTQEDHNSA-N |
| Mol Weight | 1277.5 g/mol |
| Molecular Formula | C68H92O23 |
| Exact Mass | 1276.602939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 34b5Obis9V7 |
|---|---|
| Name | P-457-OCTAACETATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H92O23 |
| InChI | InChI=1S/C68H92O23/c1-39(23-20-24-40(2)28-29-55-64(12,13)32-51(81-44(6)72)34-66(55,16)78)22-18-19-26-50(36-69)27-21-25-41(3)30-31-68-65(14,15)33-52(35-67(68,17)91-68)87-62-60(85-48(10)76)59(84-47(9)75)57(54(88-62)38-80-43(5)71)90-63-61(86-49(11)77)58(83-46(8)74)56(82-45(7)73)53(89-63)37-79-42(4)70/h18-28,36,51-54,56-63,78H,30-35,37-38H2,1-17H3/b19-18+,23-20+,27-21+,39-22+,40-24+,41-25+,50-26-/t29?,51-,52-,53+,54-,56-,57-,58-,59+,60-,61+,62-,63-,66+,67+,68-/m1/s1 |
| InChIKey | GZGKDSOONPINNS-SDTQEDHNSA-N |
| Literature Reference Author | G.ENGLERT,T.AAKEMANN,K.SCHIEDT,S.LIAAEN-JENSEN |
| Literature Reference Citation | J.NAT.PROD.,58,1675(1995) |
| Literature Reference DOI | 10.1021/np50125a005 |
| Molecular Weight | 1277.465 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS22643 |