| SpectraBase Spectrum ID |
AnqRy6mMVVU |
| Name |
A-Norcholest-22-ene-3-methanol, acetate, (3.beta.,5.alpha.,22E)- |
| CAS Registry Number |
55081-46-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48O2 |
| InChI |
InChI=1S/C29H48O2/c1-19(2)8-7-9-20(3)24-12-13-26-23-10-11-25-22(18-31-21(4)30)14-16-29(25,6)27(23)15-17-28(24,26)5/h7,9,19-20,22-27H,8,10-18H2,1-6H3/b9-7+/t20-,22-,23+,24-,25+,26+,27+,28-,29+/m1/s1 |
| InChIKey |
RPZREKQBFDZMOU-PTZGODKKSA-N |
| Molecular Weight |
428.701 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](\C=C\CC(C)C)(C)[H])[H])[H])([H])CC[C@]2([C@@](COC(=O)C)(CC1)[H])[H])[H])C |
| SPLASH |
splash10-0a6u-0089500000-e510010a65dd21e51ce1 |
| Source of Spectrum |
KC-0-74-2383 |
| Synonyms |
Dicyclopenta[a,f]naphthalene, A-norcholest-22-ene-3-methanol deriv.
3.beta.-acetoxymethyl-a-nor-5.alpha.-cholest-22-ene
{(1S,3aR,3bS,5aR,6R,8aS,8bS,10aS)-6-[(1R,2E)-1,5-dimethyl-2-hexenyl]-3a,5a-dimethylhexadecahydrodicyclopenta[a,f]naphthalen-1-yl}methyl acetate |
| Wiley ID |
1380935 |
