| SpectraBase Spectrum ID |
9kdbWaJ40Us |
| Name |
2-(1-HYDROXY-2-PHENYLETHYL)CHOLESTAN-3-ONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
506.412380977 u |
| Formula |
C35H54O2 |
| InChI |
InChI=1S/C35H54O2/c1-23(2)10-9-11-24(3)29-16-17-30-27-15-14-26-21-33(37)28(32(36)20-25-12-7-6-8-13-25)22-35(26,5)31(27)18-19-34(29,30)4/h6-8,12-13,23-24,26-32,36H,9-11,14-22H2,1-5H3/t24-,26?,27+,28?,29-,30+,31+,32?,34-,35+/m1/s1 |
| InChIKey |
QYHQJQMYWUUPGK-UDPDQHKMSA-N |
| Molecular Weight |
506.815 g/mol |
| Nominal Mass |
506 u |
| Number of Peaks |
353 |
| SMILES |
OC(Cc1ccccc1)C1C(CC2CC[C@]3([C@@]4(CC[C@]([C@@](CCCC(C)C)(C)[H])([C@@]4(C)CC[C@@]3([C@]2(C1)C)[H])[H])[H])[H])=O |
| SPLASH |
splash10-001l-9531100000-1024023f33afd73a32fa |
| Source File Reference |
LMCM-45564-938A |
| Synonyms |
17-(1,5-DIMETHYL-HEXYL)-2-(1-HYDROXY-2-PHENYL-ETHYL)-10,13-DIMETHYL-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-3-ONE
(1S,2S,10R,11S,14R,15R)-4-(1-hydroxy-2-phenylethyl)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-one |
| Wiley ID |
8_8402 |
