| SpectraBase Compound ID | ANxxb81Vmtl |
|---|---|
| InChI | InChI=1S/C23H32O4/c1-13(24)26-15-6-8-22(2)14(10-15)4-5-16-17(22)7-9-23(3)18(16)11-20-19(23)12-21(25)27-20/h4,15-20H,5-12H2,1-3H3/t15-,16+,17-,18-,19+,20+,22-,23-/m0/s1 |
| InChIKey | TXSIOLZMIFZQAZ-YTOLNPETSA-N |
| Mol Weight | 372.5 g/mol |
| Molecular Formula | C23H32O4 |
| Exact Mass | 372.23006 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 91ayuMnzB2I |
|---|---|
| Name | 3beta-Acetoxy-17alpha-pregn-5-en-21,16alpha-carbolactone |
| Alternate Name(s) | (4S,6aR,6bS,8aS,8bS,11aR,12aS,12bS)-6a,8a-dimethyl-10-oxo-3,4,5,6,6a,6b,7,8,8a,8b,9,10,11a,12,12a,12b-hexadecahydro-1H-naphtho[2',1':4,5]indeno[2,1-b]furan-4-yl acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H32O4 |
| InChI | InChI=1S/C23H32O4/c1-13(24)26-15-6-8-22(2)14(10-15)4-5-16-17(22)7-9-23(3)18(16)11-20-19(23)12-21(25)27-20/h4,15-20H,5-12H2,1-3H3/t15-,16+,17-,18-,19+,20+,22-,23-/m0/s1 |
| InChIKey | TXSIOLZMIFZQAZ-YTOLNPETSA-N |
| Literature Reference DOI | 10.1002/cber.19801131215 |
| Molecular Weight | 372.505 g/mol |
| SMILES | C1C[C@]2(C(C[C@]1(OC(C)=O)[H])=CC[C@@]1([C@@]2(CC[C@]2([C@]1(C[C@@]1([C@]2(CC(O1)=O)[H])[H])[H])C)[H])[H])C |
| SPLASH | splash10-06r6-9814000000-bcdbcc0c356374a4d213 |
| Source of Spectrum | K-113-3833-2h |
| Wiley ID | 1792651 |