| SpectraBase Compound ID | 45Dna0fpMga |
|---|---|
| InChI | InChI=1S/C31H40O8/c1-6-21-8-12-26-25-10-7-20-15-22(9-11-23(20)24(25)13-14-31(21,26)5)39-30-29(38-19(4)34)28(37-18(3)33)27(16-35-30)36-17(2)32/h6,9,11,15,21,24-30H,1,7-8,10,12-14,16H2,2-5H3/t21-,24?,25?,26?,27-,28+,29-,30-,31+/m0/s1 |
| InChIKey | LWACODQFKNENBE-VUZMMIHMSA-N |
| Mol Weight | 540.7 g/mol |
| Molecular Formula | C31H40O8 |
| Exact Mass | 540.272318 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | NTQArdb4n5 |
|---|---|
| Name | 19-nor-Pregna-1,3,5(10),20-tetraen-3-O-.alpha.-arabinopyranoside - 2',3',4'-Triacetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H40O8 |
| InChI | InChI=1S/C31H40O8/c1-6-21-8-12-26-25-10-7-20-15-22(9-11-23(20)24(25)13-14-31(21,26)5)39-30-29(38-19(4)34)28(37-18(3)33)27(16-35-30)36-17(2)32/h6,9,11,15,21,24-30H,1,7-8,10,12-14,16H2,2-5H3/t21-,24?,25?,26?,27-,28+,29-,30-,31+/m0/s1 |
| InChIKey | LWACODQFKNENBE-VUZMMIHMSA-N |
| Molecular Weight | 540.653 g/mol |
| SMILES | [C@]1([C@@]([C@@](OC(=O)C)(CO[C@]1(Oc1cc2CCC3C4[C@]([C@@](C=C)(CC4)[H])(C)CCC3c2cc1)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H] |
| SPLASH | splash10-03di-0290000000-09adef908471694fc4f6 |
| Source of Spectrum | G4-62-320-4 |
| Wiley ID | 1607756 |