| SpectraBase Spectrum ID |
Fal17psqG5G |
| Name |
2,3-DIHYDROXYCHOLEST-4-EN-6-ONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
416.329045274 u |
| Formula |
C27H44O3 |
| InChI |
InChI=1S/C27H44O3/c1-16(2)7-6-8-17(3)19-9-10-20-18-13-23(28)22-14-24(29)25(30)15-27(22,5)21(18)11-12-26(19,20)4/h14,16-21,24-25,29-30H,6-13,15H2,1-5H3/t17-,18+,19-,20+,21+,24?,25?,26-,27-/m1/s1 |
| InChIKey |
DHDBOVIXVFKNCT-ZVFBGJCOSA-N |
| Molecular Weight |
416.646 g/mol |
| Nominal Mass |
416 u |
| Number of Peaks |
380 |
| SMILES |
OC1C(C=C2C(C[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@@]3([C@]2(C1)C)[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])=O)O |
| SPLASH |
splash10-0aou-9712100000-d25ab774cf92cf26b7ee |
| Source File Reference |
LMCM-57536-374B |
| Synonyms |
(1S,2R,10S,11S,14R,15R)-4,5-dihydroxy-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-6-en-8-one
17-(1,5-DIMETHYL-HEXYL)-2,3-DIHYDROXY-10,13-DIMETHYL-1,2,3,7,8,9,10,11,12,13,14,15,16,17-TETRADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-6-O |
| Wiley ID |
8_8800 |
