| SpectraBase Compound ID | JVOEAat0JlH |
|---|---|
| InChI | InChI=1S/C37H66O8/c1-3-4-5-6-7-11-14-17-20-30(39)33-22-23-34(44-33)35-26-32(41)36(45-35)31(40)21-18-15-12-9-8-10-13-16-19-29(38)25-28-24-27(2)43-37(28)42/h24,27,29-36,38-41H,3-23,25-26H2,1-2H3/t27-,29+,30+,31+,32-,33+,34+,35-,36+/m1/s1 |
| InChIKey | NNTXABWKPQWPML-GXVLSIIZSA-N |
| Mol Weight | 638.9 g/mol |
| Molecular Formula | C37H66O8 |
| Exact Mass | 638.475769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 29cXp1LvLlW |
|---|---|
| Name | ASIMITRIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H66O8 |
| InChI | InChI=1S/C37H66O8/c1-3-4-5-6-7-11-14-17-20-30(39)33-22-23-34(44-33)35-26-32(41)36(45-35)31(40)21-18-15-12-9-8-10-13-16-19-29(38)25-28-24-27(2)43-37(28)42/h24,27,29-36,38-41H,3-23,25-26H2,1-2H3/t27-,29+,30+,31+,32-,33+,34+,35-,36+/m1/s1 |
| InChIKey | NNTXABWKPQWPML-GXVLSIIZSA-N |
| Literature Reference Author | E.J.KIM,K.M.SUH,D.H.KIM,E.J.JUNG,C.S.SEO,J.K.SON,M.H.WOO,J.L .MCLAUGHLIN |
| Literature Reference Citation | J.NAT.PROD.,68,194(2005) |
| Literature Reference DOI | 10.1021/np040184l |
| Molecular Weight | 638.926 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ8830 |