| SpectraBase Compound ID | jr2RYWdDnO |
|---|---|
| InChI | InChI=1S/C37H66O7/c1-3-4-5-15-19-30(38)20-17-22-32(40)34-24-26-36(44-34)35-25-23-33(43-35)31(39)21-16-13-11-9-7-6-8-10-12-14-18-29-27-28(2)42-37(29)41/h27-28,30-36,38-40H,3-26H2,1-2H3/t28-,30+,31+,32-,33+,34-,35+,36+/m1/s1 |
| InChIKey | DAEFUOXKPZLQMM-UDJBOWHQSA-N |
| Mol Weight | 622.9 g/mol |
| Molecular Formula | C37H66O7 |
| Exact Mass | 622.480854 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6IBmax1rvvR |
|---|---|
| Name | ASITRIBIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H66O7 |
| InChI | InChI=1S/C37H66O7/c1-3-4-5-15-19-30(38)20-17-22-32(40)34-24-26-36(44-34)35-25-23-33(43-35)31(39)21-16-13-11-9-7-6-8-10-12-14-18-29-27-28(2)42-37(29)41/h27-28,30-36,38-40H,3-26H2,1-2H3/t28-,30+,31+,32-,33+,34-,35+,36+/m1/s1 |
| InChIKey | DAEFUOXKPZLQMM-UDJBOWHQSA-N |
| Literature Reference Author | M.HEEWOO,L.ZENG,J.MCLAUGHIN |
| Literature Reference Citation | HETEROCYCLES,41,1731(1995) |
| Literature Reference DOI | 10.3987/COM-95-7099 |
| Molecular Weight | 622.927 g/mol |
| Solvent | CDCl3 |
| Source File Reference | WANG101 |