| SpectraBase Compound ID | 6qsmYQxhnkl |
|---|---|
| InChI | InChI=1S/C34H46O16/c1-16(2)11-24(39)50-29-26(45-18(4)36)28(46-19(5)37)32(7)22(48-25(40)13-35)10-9-21(14-43-8)12-23-34(42,17(3)31(41)49-23)30(47-20(6)38)27(32)33(29)15-44-33/h9-10,12,16-17,22-23,26-30,35,42H,11,13-15H2,1-8H3/b10-9-,21-12+/t17-,22-,23-,26+,27+,28-,29+,30-,32+,33+,34-/m0/s1 |
| InChIKey | OLSYKOBNGGUPBJ-UOGQROAJSA-N |
| Mol Weight | 710.7 g/mol |
| Molecular Formula | C34H46O16 |
| Exact Mass | 710.278585 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LyHTNtJuRTy |
|---|---|
| Name | GEMMACOLIDE-AB |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H46O16 |
| InChI | InChI=1S/C34H46O16/c1-16(2)11-24(39)50-29-26(45-18(4)36)28(46-19(5)37)32(7)22(48-25(40)13-35)10-9-21(14-43-8)12-23-34(42,17(3)31(41)49-23)30(47-20(6)38)27(32)33(29)15-44-33/h9-10,12,16-17,22-23,26-30,35,42H,11,13-15H2,1-8H3/b10-9-,21-12+/t17-,22-,23-,26+,27+,28-,29+,30-,32+,33+,34-/m0/s1 |
| InChIKey | OLSYKOBNGGUPBJ-UOGQROAJSA-N |
| Literature Reference Author | C.LI,M.JIANG,M.P.LA,T.J.LI,H.TANG,P.SUN,B.S.LIU,Y.H.YI,Z.LIU ,W.ZHANG |
| Literature Reference Citation | MAR.DRUGS,11,1565(2013) |
| Literature Reference DOI | 10.3390/md11051565 |
| Molecular Weight | 710.730 g/mol |
| Source File Reference | UWLU74833 |