| SpectraBase Spectrum ID |
Z6CvHRQcYA |
| Name |
[3S-(3.alpha.,3a.alpha.,5aS,7a.alpha.,11a.beta.,11b.alpha.)]-(+)-1,3,3a,6,7,7a,8,9,10,11,11a,11b-Dodecahydro-8,8,11a-trimethyl-3-([tris(methylthio)methyl]-2H-cyclobuta[j]phenanthren-3-ol |
| Alternate Name(s) |
(3R,3aR,5aS,7aS,11aR,11bS)-8,8,11-trimethyl-3-[tris(methylsulfanyl)methyl]-1,3,3a,6,7,7a,8,9,10,11,11a,11b-dodecahydro-2H-cyclobuta[j]phenanthren-3-ol |
| CAS Registry Number |
138644-34-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H38OS3 |
| InChI |
InChI=1S/C23H38OS3/c1-15-7-11-20(2,3)16-8-12-21-13-10-18(21)22(24,14-9-17(21)19(15)16)23(25-4,26-5)27-6/h10,13,15-19,24H,7-9,11-12,14H2,1-6H3/t15?,16-,17-,18+,19+,21-,22+/m0/s1 |
| InChIKey |
OWDRYYZRTGOGKC-ATPWQVLUSA-N |
| Molecular Weight |
426.736 g/mol |
| SMILES |
O[C@]1([C@]2([C@]3([C@]([C@@]4(C(CCC([C@]4(CC3)[H])(C)C)C)[H])(CC1)[H])C=C2)[H])C(SC)(SC)SC |
| SPLASH |
splash10-0f6x-9500000000-4baec036a5f5b5def003 |
| Source of Spectrum |
J-57-6867-9 |
| Wiley ID |
1379925 |
![[3S-(3.alpha.,3a.alpha.,5aS,7a.alpha.,11a.beta.,11b.alpha.)]-(+)-1,3,3a,6,7,7a,8,9,10,11,11a,11b-Dodecahydro-8,8,11a-trimethyl-3-([tris(methylthio)methyl]-2H-cyclobuta[j]phenanthren-3-ol](/api/spectrum/Z6CvHRQcYA/structure.png?h=300&w=458 "[3S-(3.alpha.,3a.alpha.,5aS,7a.alpha.,11a.beta.,11b.alpha.)]-(+)-1,3,3a,6,7,7a,8,9,10,11,11a,11b-Dodecahydro-8,8,11a-trimethyl-3-([tris(methylthio)methyl]-2H-cyclobuta[j]phenanthren-3-ol")
