| SpectraBase Spectrum ID |
3CaNSUHEPqy |
| Name |
1H-Cyclopenta[a]chrysene, D:C-friedo-B':A'-neogammacer-9(11)-ene-3,12-dione deriv. |
| CAS Registry Number |
53527-39-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H46O2 |
| InChI |
InChI=1S/C30H46O2/c1-18(2)19-9-12-23-28(19,6)15-16-29(7)20-10-11-22-26(3,4)24(31)13-14-27(22,5)21(20)17-25(32)30(23,29)8/h17-20,22-23H,9-16H2,1-8H3/t19-,20?,22?,23?,27+,28-,29-,30-/m0/s1 |
| InChIKey |
VDTHVIBNEHUNHK-NCGYHRKXSA-N |
| Molecular Weight |
438.696 g/mol |
| SMILES |
C=12[C@@]3(C(C(C)(C)C(CC3)=O)CCC2[C@@]2(CC[C@@]3(C([C@]2(C(C1)=O)C)CC[C@]3(C(C)C)[H])C)C)C |
| SPLASH |
splash10-0079-0423900000-5bd37e8af2109275dce1 |
| Source of Spectrum |
B-43-627-2 |
| Synonyms |
D:C-Friedo-B':A'-neogammacer-9(11)-ene-3,12-dione
(3S,3aS,5aS,11aS,13aR)-3-isopropyl-3a,5a,8,8,11a,13a-hexamethyl-3,3a,4,5,5a,5b,6,7,7a,10,11,11a,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-9,13(2H,8H)-dione
Fern-9(11)-ene-3,12-dione |
| Wiley ID |
1384328 |
![1H-Cyclopenta[a]chrysene, D:C-friedo-B':A'-neogammacer-9(11)-ene-3,12-dione deriv.](/api/spectrum/3CaNSUHEPqy/structure.png?h=300&w=458 "1H-Cyclopenta[a]chrysene, D:C-friedo-B':A'-neogammacer-9(11)-ene-3,12-dione deriv.")
