| SpectraBase Spectrum ID |
6hVNO8BMgbJ |
| Name |
CHOLEST-5-EN-3-YL BENZOATE |
| CAS Registry Number |
604-32-0 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
490.381080848 u |
| Formula |
C34H50O2 |
| InChI |
InChI=1S/C34H50O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-14,23-24,27-31H,9-11,15-22H2,1-5H3/t24-,27?,28?,29-,30?,31?,33+,34-/m1/s1 |
| InChIKey |
UVZUFUGNHDDLRQ-PYXSXCGNSA-N |
| Molecular Weight |
490.772 g/mol |
| Nominal Mass |
490 u |
| Number of Peaks |
253 |
| SMILES |
C(c1ccccc1)(=O)OC1CC[C@@]2(C3CC[C@@]4([C@](CCC4C3CC=C2C1)([C@@](CCCC(C)C)(C)[H])[H])C)C |
| SPLASH |
splash10-052f-9711000000-4a75c90eb2119ea1504b |
| Source File Reference |
LMCM-66375-716K |
| Synonyms |
CHOLESTERINBENZOAT
(2R,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-yl benzoate |
| Wiley ID |
8_5977 |
