SpectraBase Compound ID | LFxQeGJNXQH |
---|---|
InChI | InChI=1S/C26H41NO7/c1-6-27-11-24(12-31-3)8-7-17(29)26-15-9-14-16(32-4)10-25(30,18(15)20(14)34-13(2)28)19(23(26)27)21(33-5)22(24)26/h14-23,29-30H,6-12H2,1-5H3/t14-,15-,16+,17-,18-,19+,20+,21+,22-,23-,24+,25-,26+/m1/s1 |
InChIKey | RVSYWRBZSPBTQV-VAIMCWLPSA-N |
Mol Weight | 479.6 g/mol |
Molecular Formula | C26H41NO7 |
Exact Mass | 479.288303 g/mol |
SpectraBase Spectrum ID | DbWtWDs7S3f |
---|---|
Name | 1-(epi)-14-Acetylneoline |
Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C26H41NO7 |
InChI | InChI=1S/C26H41NO7/c1-6-27-11-24(12-31-3)8-7-17(29)26-15-9-14-16(32-4)10-25(30,18(15)20(14)34-13(2)28)19(23(26)27)21(33-5)22(24)26/h14-23,29-30H,6-12H2,1-5H3/t14-,15-,16+,17-,18-,19+,20+,21+,22-,23-,24+,25-,26+/m1/s1 |
InChIKey | RVSYWRBZSPBTQV-VAIMCWLPSA-N |
Molecular Weight | 479.614 g/mol |
SMILES | O[C@@]1(CC[C@@]2([C@]3([C@]([C@]4([C@]([C@@]13[C@]1([C@]3([C@@]4(C[C@@]([C@@](C1)([C@@]3(OC(=O)C)[H])[H])(OC)[H])O)[H])[H])(N(C2)CC)[H])[H])(OC)[H])[H])COC)[H] |
SPLASH | splash10-052o-9100000000-54c28a9fdab76a342f22 |
Source of Spectrum | X2-52-150-13 |
Wiley ID | 1603016 |