| SpectraBase Compound ID | 36tR85mv1eG |
|---|---|
| InChI | InChI=1S/C44H60O17/c1-7-15-30-18-13-10-14-19-32(55-27(5)45)31(47)21-23-34(48)53-24-33-39(59-35(49)22-20-29-16-11-9-12-17-29)40(60-42(52)25(3)8-2)37(51)43(58-33)61-41-36(50)38(56-28(6)46)26(4)54-44(41)57-30/h8-9,11-12,16-17,20,22,26,30,32-33,36-41,43-44,50-51H,7,10,13-15,18-19,21,23-24H2,1-6H3/b22-20+,25-8+/t26-,30+,32-,33-,36+,37-,38-,39-,40-,41+,43+,44-/m0/s1 |
| InChIKey | RGCFRCYTLQGODZ-HUWFSVOHSA-N |
| Mol Weight | 860.9 g/mol |
| Molecular Formula | C44H60O17 |
| Exact Mass | 860.38305 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5241NFvHSfE |
|---|---|
| Name | IPOMOEASSIN-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H60O17 |
| InChI | InChI=1S/C44H60O17/c1-7-15-30-18-13-10-14-19-32(55-27(5)45)31(47)21-23-34(48)53-24-33-39(59-35(49)22-20-29-16-11-9-12-17-29)40(60-42(52)25(3)8-2)37(51)43(58-33)61-41-36(50)38(56-28(6)46)26(4)54-44(41)57-30/h8-9,11-12,16-17,20,22,26,30,32-33,36-41,43-44,50-51H,7,10,13-15,18-19,21,23-24H2,1-6H3/b22-20+,25-8+/t26-,30+,32-,33-,36+,37-,38-,39-,40-,41+,43+,44-/m0/s1 |
| InChIKey | RGCFRCYTLQGODZ-HUWFSVOHSA-N |
| Literature Reference Author | S.CAO,R.C.GUZA,J.H.WISE,J.S.MILLER,R.EVANS,D.G.I.KINGSTON |
| Literature Reference Citation | J.NAT.PROD.,68,487(2005) |
| Literature Reference DOI | 10.1021/np049629w |
| Molecular Weight | 860.950 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWMZ9437 |