| SpectraBase Spectrum ID |
DY9zSUUJiAq |
| Name |
1H-Benz[e]indene-7-acetic acid, 6-ethyldodecahydro-3-hydroxy-3a-methyl-, 1,1-dimethylethyl ester, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,7.alpha.,9a.alpha.,9b.beta.)]- |
| CAS Registry Number |
100021-06-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H38O3 |
| InChI |
InChI=1S/C22H38O3/c1-6-15-14(13-20(24)25-21(2,3)4)7-8-17-16(15)11-12-22(5)18(17)9-10-19(22)23/h14-19,23H,6-13H2,1-5H3/t14-,15-,16+,17+,18-,19-,22-/m0/s1 |
| InChIKey |
UDJAUEFWTQSWHS-SSHXTSQHSA-N |
| Molecular Weight |
350.543 g/mol |
| SMILES |
O[C@@]1([C@@]2([C@]([C@@]3(CC[C@]([C@@]([C@]3(CC2)[H])(CC)[H])(CC(OC(C)(C)C)=O)[H])[H])(CC1)[H])C)[H] |
| SPLASH |
splash10-0zfs-4029000000-b9e13fd356d20d7107ea |
| Source of Spectrum |
J-51-772-4 |
| Synonyms |
tert-Butyl[(3S,3aS,5aR,6S,7S,9aR,9bS)-6-ethyl-3-hydroxy-3a-methyldodecahydro-1H-cyclopenta[a]naphthalen-7-yl]acetate |
| Wiley ID |
1342258 |
![1H-Benz[e]indene-7-acetic acid, 6-ethyldodecahydro-3-hydroxy-3a-methyl-, 1,1-dimethylethyl ester, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,7.alpha.,9a.alpha.,9b.beta.)]-](/api/spectrum/DY9zSUUJiAq/structure.png?h=300&w=458 "1H-Benz[e]indene-7-acetic acid, 6-ethyldodecahydro-3-hydroxy-3a-methyl-, 1,1-dimethylethyl ester, [3S-(3.alpha.,3a.alpha.,5a.beta.,6.beta.,7.alpha.,9a.alpha.,9b.beta.)]-")
