| SpectraBase Compound ID | DJHB5wPZB6o |
|---|---|
| InChI | InChI=1S/C33H47NO9/c1-7-34-15-31(16-38-2)11-10-23(35)33-19-13-18-22(41-5)14-32(37,25(29(33)34)27(42-6)28(31)33)24(19)26(18)43-30(36)17-8-9-20(39-3)21(12-17)40-4/h8-9,12,18-19,22-29,35,37H,7,10-11,13-16H2,1-6H3/t18-,19?,22+,23+,24?,25?,26+,27+,28?,29?,31+,32-,33?/m1/s1 |
| InChIKey | LZXVEXAXOOENIF-XEVVHMDOSA-N |
| Mol Weight | 601.7 g/mol |
| Molecular Formula | C33H47NO9 |
| Exact Mass | 601.325082 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EMrGULV3xQ4 |
|---|---|
| Name | 14-O-Veratroylneoline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H47NO9 |
| InChI | InChI=1S/C33H47NO9/c1-7-34-15-31(16-38-2)11-10-23(35)33-19-13-18-22(41-5)14-32(37,25(29(33)34)27(42-6)28(31)33)24(19)26(18)43-30(36)17-8-9-20(39-3)21(12-17)40-4/h8-9,12,18-19,22-29,35,37H,7,10-11,13-16H2,1-6H3/t18-,19?,22+,23+,24?,25?,26+,27+,28?,29?,31+,32-,33?/m1/s1 |
| InChIKey | LZXVEXAXOOENIF-XEVVHMDOSA-N |
| Molecular Weight | 601.737 g/mol |
| SMILES | O[C@]1(CC[C@@]2(C3[C@](C4C(C13C1C3[C@@]4(C[C@@]([C@](C1)([H])[C@@]3(OC(c1cc(OC)c(cc1)OC)=O)[H])(OC)[H])O)N(C2)CC)(OC)[H])COC)[H] |
| SPLASH | splash10-014i-0900050000-054128a38d6c01c2268e |
| Source of Spectrum | E2-51-1002-5 |
| Wiley ID | 1556232 |