| SpectraBase Compound ID | 51OQWhv4OjQ |
|---|---|
| InChI | InChI=1S/C29H46O3/c1-18(2)8-7-9-19(3)22-11-12-23-21-10-13-26(32-20(4)30)27-25(31)15-17-29(27,6)24(21)14-16-28(22,23)5/h18-19,21-24H,7-17H2,1-6H3/t19-,21+,22-,23+,24+,28-,29-/m1/s1 |
| InChIKey | AEMQMHYPHPLWLZ-TYCSKGGISA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C29H46O3 |
| Exact Mass | 442.344695 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3uuFn2OepfJ |
|---|---|
| Name | B-Homo-A-norcholest-5-en-3-one, 6-(acetyloxy)- |
| CAS Registry Number | 6987-48-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H46O3 |
| InChI | InChI=1S/C29H46O3/c1-18(2)8-7-9-19(3)22-11-12-23-21-10-13-26(32-20(4)30)27-25(31)15-17-29(27,6)24(21)14-16-28(22,23)5/h18-19,21-24H,7-17H2,1-6H3/t19-,21+,22-,23+,24+,28-,29-/m1/s1 |
| InChIKey | AEMQMHYPHPLWLZ-TYCSKGGISA-N |
| Molecular Weight | 442.684 g/mol |
| SMILES | [C@]12(C(=C(OC(=O)C)CC[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@]23[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])C(=O)CC1)C |
| SPLASH | splash10-0f79-0900000000-f6c1b6a29b5c1788af83 |
| Source of Spectrum | KC-1982-936-0 |
| Synonyms | (3aR,3bS,5aR,6R,8aS,8bS)-6-[(1R)-1,5-dimethylhexyl]-3a,5a-dimethyl-1-oxo-2,3,3a,3b,4,5,5a,6,7,8,8a,8b,9,10-tetradecahydro-1H-indeno[5,4-e]azulen-11-yl acetate 1H-indeno[5,4-e]azulene, b-homo-a-norcholest-5-en-3-one deriv. 6-Acetoxy-a-nor-b-homocholest-5-en-3-one b-homo-a-norcholest-5-en-3-one, 6-hydroxy-, acetate |
| Wiley ID | 1385509 |