| SpectraBase Spectrum ID |
7zhxeUrEBow |
| Name |
14-Oxo-13,14-seco-5.alpha.-cholest-13(18)-en-3.beta.,12.psi.,15.psi-triyl triacetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H52O7 |
| InChI |
InChI=1S/C33H52O7/c1-7-8-9-10-11-12-13-25-18-31(40-24(5)36)32(37)28-15-14-26-19-27(38-22(3)34)16-17-33(26,6)29(28)20-30(21(25)2)39-23(4)35/h25-31H,2,7-20H2,1,3-6H3/t25-,26-,27-,28?,29?,30?,31?,33-/m0/s1 |
| InChIKey |
DWGBSXQJVRDXIO-GBXZJEHVSA-N |
| Molecular Weight |
560.772 g/mol |
| SMILES |
C12[C@@]3([C@@](C[C@@](OC(=O)C)(CC3)[H])([H])CCC1C(C(C[C@@](C(C(C2)OC(=O)C)=C)(CCCCCCCC)[H])OC(=O)C)=O)C |
| SPLASH |
splash10-004l-0009800000-f9268925c6ed7b562fc7 |
| Source of Spectrum |
H-82-719-8 |
| Synonyms |
(3S,4aS,10S,13bS)-3,12-bis(acetyloxy)-13b-methyl-11-methylene-10-octyl-7-oxohexadecahydro-1H-cyclonona[a]naphthalen-8-yl acetate |
| Wiley ID |
815486 |
