| SpectraBase Compound ID | L6yPdjmcoXM |
|---|---|
| InChI | InChI=1S/C34H39NO11/c1-19-16-26(42-20(2)36)28(44-22(4)38)33(18-41-31(40)25-14-10-11-15-35-25)29(45-30(39)23-12-8-7-9-13-23)27(43-21(3)37)24-17-34(19,33)46-32(24,5)6/h7-15,19,24,26-29H,16-18H2,1-6H3/t19-,24+,26?,27?,28?,29?,33?,34+/m1/s1 |
| InChIKey | BOSWOPWZUWOKCS-LETVGNLCSA-N |
| Mol Weight | 637.7 g/mol |
| Molecular Formula | C34H39NO11 |
| Exact Mass | 637.252311 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7lymdMPfswH |
|---|---|
| Name | Angulatusine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H39NO11 |
| InChI | InChI=1S/C34H39NO11/c1-19-16-26(42-20(2)36)28(44-22(4)38)33(18-41-31(40)25-14-10-11-15-35-25)29(45-30(39)23-12-8-7-9-13-23)27(43-21(3)37)24-17-34(19,33)46-32(24,5)6/h7-15,19,24,26-29H,16-18H2,1-6H3/t19-,24+,26?,27?,28?,29?,33?,34+/m1/s1 |
| InChIKey | BOSWOPWZUWOKCS-LETVGNLCSA-N |
| Molecular Weight | 637.682 g/mol |
| SMILES | C12([C@@]3(OC(C)(C)[C@](C(C2OC(=O)c2ccccc2)OC(=O)C)(C3)[H])[C@@](C)([H])CC(C1OC(=O)C)OC(=O)C)COC(c1ncccc1)=O |
| SPLASH | splash10-05di-2810090000-924af8bf16aa2011af48 |
| Source of Spectrum | X2-55-983-1 |
| Wiley ID | 1604565 |