| SpectraBase Spectrum ID |
B4PuRgGRwtU |
| Name |
[3S-(3.alpha.,3a.alpha.,5aR,7a.alpha.,11a.beta.,11b.alpha.)]-(+)-1,3,3a,6,7,7a,8,9,10,11,11a,11b-Dodecahydro-8,8,11a-trimethyl-2H-cyclobuta[j]phenanthren-3-carboxylic Acid Methyl ester |
| Alternate Name(s) |
Methyl (3R,3aS,5aR,7aR,11aR,11bS)-8,8,11a-trimethyl-1,3,3a,6,7,7a,8,9,10,11,11a,11b-dodecahydro-2H-cyclobuta[j]phenanthrene-3-carboxylate |
| CAS Registry Number |
138750-67-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H32O2 |
| InChI |
InChI=1S/C21H32O2/c1-19(2)10-5-11-20(3)16(19)9-13-21-12-8-15(21)14(18(22)23-4)6-7-17(20)21/h8,12,14-17H,5-7,9-11,13H2,1-4H3/t14-,15+,16-,17+,20-,21+/m1/s1 |
| InChIKey |
NORLVDOPZIRTEN-HGWRGTDWSA-N |
| Molecular Weight |
316.485 g/mol |
| SMILES |
[C@@]123[C@]([C@@]4(CCCC([C@]4(CC3)[H])(C)C)C)(CC[C@]([C@]2([H])C=C1)(C(=O)OC)[H])[H] |
| SPLASH |
splash10-0006-9201000000-9bc636bb5a697e0f56ad |
| Source of Spectrum |
J-57-6868-13 |
| Wiley ID |
1317314 |
![[3S-(3.alpha.,3a.alpha.,5aR,7a.alpha.,11a.beta.,11b.alpha.)]-(+)-1,3,3a,6,7,7a,8,9,10,11,11a,11b-Dodecahydro-8,8,11a-trimethyl-2H-cyclobuta[j]phenanthren-3-carboxylic Acid Methyl ester](/api/spectrum/B4PuRgGRwtU/structure.png?h=300&w=458 "[3S-(3.alpha.,3a.alpha.,5aR,7a.alpha.,11a.beta.,11b.alpha.)]-(+)-1,3,3a,6,7,7a,8,9,10,11,11a,11b-Dodecahydro-8,8,11a-trimethyl-2H-cyclobuta[j]phenanthren-3-carboxylic Acid Methyl ester")
