| SpectraBase Spectrum ID |
G27hOYhpysk |
| Name |
CHOLEST-5-EN-3-YL STEARATE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
652.615831814 u |
| Formula |
C45H80O2 |
| InChI |
InChI=1S/C45H80O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38?,39?,40-,41?,42?,44+,45-/m1/s1 |
| InChIKey |
XHRPOTDGOASDJS-QAYFBHNISA-N |
| Molecular Weight |
653.133 g/mol |
| Nominal Mass |
652 u |
| Number of Peaks |
227 |
| SMILES |
C(CCCCCCCCCCCCCCCCC)(=O)OC1CC[C@@]2(C3CC[C@@]4([C@](CCC4C3CC=C2C1)([C@@](CCCC(C)C)(C)[H])[H])C)C |
| SPLASH |
splash10-052f-9711000000-ddf2b5a87a430bf77e70 |
| Source File Reference |
LMCM-30637-035Z |
| Synonyms |
CHOLESTERINSTEARAT
(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 octadecanoate |
| Wiley ID |
8_5976 |
