| SpectraBase Spectrum ID |
D6ef7sWmhAb |
| Name |
(3.beta.,20R,24R)-3-succinoxyergost-5-ene |
| Appearance |
White powder |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
500.386560150 u |
| Formula |
C32H52O4 |
| GC Column |
Rtx??-5MS (30 mm x 0.25 mm, film thickness 0.25 micrometer) |
| InChI |
InChI=1S/C32H52O4/c1-20(2)21(3)7-8-22(4)26-11-12-27-25-10-9-23-19-24(36-30(35)14-13-29(33)34)15-17-31(23,5)28(25)16-18-32(26,27)6/h9,20-22,24-28H,7-8,10-19H2,1-6H3,(H,33,34)/t21-,22-,24+,25+,26-,27+,28+,31+,32-/m1/s1 |
| InChIKey |
FXUZSVPIPDYCCM-DTNPJUTMSA-N |
| Instrument Name |
Shimadzu GC/MS QP-2010 SE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/cbdv.202300536 |
| Molecular Weight |
500.764 g/mol |
| Optical Rotation |
[a]D21= -30.93 (c = 0.1, CHCl3) |
| Quality |
464 |
| SMILES |
OC(CCC(O[C@@]1(CC=2[C@](CC1)([C@@]1([C@@](CC2)([C@]2([C@](CC1)([C@](CC2)([C@](C)(CC[C@](C(C)C)(C)[H])[H])[H])C)[H])[H])[H])C)[H])=O)=O |
| SPLASH |
splash10-052b-6950000000-896aa0827d56660ef0e3 |
| Source of Spectrum |
CBD-20-SM15-6 (DOI: 10.1002/cbdv.202300536) |
| Thin-Layer Chromatography |
0.53 (hexane/AcOEt, 50:50) |
| Wiley ID |
1909890 |
