| SpectraBase Spectrum ID |
BL4L2NoQ1s2 |
| Name |
5-Oxo-15,18(R or S),19-trihydroxyspata-13,16(E)-diene |
| Alternate Name(s) |
(3R,3aR,3bR,4R,6aS,6bR)-4,6b-dimethyl-3-[(3E)-2,5,6-trihydroxy-5-methyl-1-methylene-3-hexenyl]octahydrocyclopenta[3,4]cyclobuta[1,2-a]cyclopenten-1(2H)-one |
| CAS Registry Number |
77136-62-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-11-5-6-14-17(11)18-13(9-16(23)20(14,18)4)12(2)15(22)7-8-19(3,24)10-21/h7-8,11,13-15,17-18,21-22,24H,2,5-6,9-10H2,1,3-4H3/b8-7+/t11-,13+,14+,15?,17-,18+,19?,20+/m1/s1 |
| InChIKey |
PIQKTPMDCOQYRT-SUDSZUCTSA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
OC(CO)(\C=C\C(C([C@]1([C@@]2([C@@]([C@@]3([C@]2([C@](C)(CC3)[H])[H])[H])(C(C1)=O)C)[H])[H])=C)O)C |
| SPLASH |
splash10-0udi-5932000000-fd9ca799d6356718fd49 |
| Source of Spectrum |
J-46-2239-0 |
| Wiley ID |
1331105 |
