| SpectraBase Compound ID | Ccf8R9kyU0S |
|---|---|
| InChI | InChI=1S/C42H58O15/c1-6-15-30-19-14-9-8-13-18-29(44)21-23-32(45)50-24-31-37(55-33(46)22-20-28-16-11-10-12-17-28)38(56-40(49)25(3)7-2)35(48)41(54-31)57-39-34(47)36(52-27(5)43)26(4)51-42(39)53-30/h7,10-12,16-17,20,22,26,30-31,34-39,41-42,47-48H,6,8-9,13-15,18-19,21,23-24H2,1-5H3/b22-20+,25-7+/t26-,30+,31-,34+,35-,36-,37-,38-,39+,41+,42-/m1/s1 |
| InChIKey | UIMJTDXGFNDFRJ-VPLGLFQXSA-N |
| Mol Weight | 802.9 g/mol |
| Molecular Formula | C42H58O15 |
| Exact Mass | 802.377571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Q6Q6kFg54L |
|---|---|
| Name | IPOMOEASSIN-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H58O15 |
| InChI | InChI=1S/C42H58O15/c1-6-15-30-19-14-9-8-13-18-29(44)21-23-32(45)50-24-31-37(55-33(46)22-20-28-16-11-10-12-17-28)38(56-40(49)25(3)7-2)35(48)41(54-31)57-39-34(47)36(52-27(5)43)26(4)51-42(39)53-30/h7,10-12,16-17,20,22,26,30-31,34-39,41-42,47-48H,6,8-9,13-15,18-19,21,23-24H2,1-5H3/b22-20+,25-7+/t26-,30+,31-,34+,35-,36-,37-,38-,39+,41+,42-/m1/s1 |
| InChIKey | UIMJTDXGFNDFRJ-VPLGLFQXSA-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 | 802.914 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWMZ9434 |