| SpectraBase Spectrum ID |
3Qr8ToMjXto |
| Name |
27-Norergostan-26-oic acid, 3-hydroxy-4,23-dimethyl-, methyl ester, (3.beta.,4.alpha.,5.alpha.,23R)- |
| Alternate Name(s) |
(23R,24R)-methyl 3.beta.-hydroxy-4.alpha.,23,24-trimethyl-27-nor-5.alpha.-cholestan-26-oates
Methyl (3R,4R,6R)-6-[(1S,2R,5S,6S,7S,10S,11S,14R,15R)-5-hydroxy-2,6,15-trimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl]-3,4-dimethylheptanoate |
| CAS Registry Number |
114011-42-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H52O3 |
| InChI |
InChI=1S/C30H52O3/c1-18(19(2)17-28(32)33-7)16-20(3)23-10-11-25-22-8-9-24-21(4)27(31)13-15-30(24,6)26(22)12-14-29(23,25)5/h18-27,31H,8-17H2,1-7H3/t18-,19-,20-,21+,22+,23-,24+,25+,26+,27+,29-,30+/m1/s1 |
| InChIKey |
VDODOVXEZZKXFK-ZGZVRJORSA-N |
| Molecular Weight |
460.743 g/mol |
| SMILES |
O[C@]1(CC[C@@]2([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](C[C@]([C@@](CC(=O)OC)(C)[H])(C)[H])(C)[H])[H])[H])([H])CC[C@]2([C@@]1(C)[H])[H])[H])C)[H] |
| SPLASH |
splash10-01r6-0130900000-736c08325e5d49ea6fc7 |
| Source of Spectrum |
KC-1987-1301-16 |
| Wiley ID |
1390662 |
