Compound Summary
CP55940
Compound Information
CP55940
Compound Name: | CP55940 |
Compound CID: | 104895 |
Synonyms: | CP55940 CP-55940 2-(1r,2r,5r)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl-5-(2-methyloctan-2-yl)phenol CP55,940 83002-04-4 More... |
Iupac Name: | 2-[(1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl]-5-(2-methyloctan-2-yl)phenol |
InChI: | InChI=1S/C24H40O3/c1-4-5-6-7-14-24(2,3)19-11-13-21(23(27)16-19)22-17-20(26)12-10-18(22)9-8-15-25/h11,13,16,18,20,22,25-27H,4-10,12,14-15,17H2,1-3H3/t18-,20-,22-/m1/s1 |
InChIKey: | YNZFFALZMRAPHQ-SYYKKAFVSA-N |
Canonical Smiles: | CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCC2CCCO)O)O |
Isomeric Smiles: | CCCCCCC(C)(C)C1=CC(=C(C=C1)[C@@H]2C[C@@H](CC[C@H]2CCCO)O)O |
Molecular Weight: | 376.6 |
Molecular Formula: | C24H40O3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
CP55940
Molecular Weight: | 376.6 |
Molecular Formula: | C24H40O3 |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 3 |
Rotatable Bond Count: | 10 |
Heavy Atom Count: | 27 |
Complexity: | 408 |
Synonyms
CP55940
| CP55940 | CP55940 |
|---|---|
CP55940 |
CP-55940 |
2-(1r,2r,5r)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl-5-(2-methyloctan-2-yl)phenol |
CP55,940 |
83002-04-4 |
UNII-KFY70972J5 |
CP-55,940 |
83003-12-7 |
CP 55,940 |
KFY70972J5 |
CP 55940 |
3-(2-hydroxy-4-(1,1-dimethylheptyl)phenyl)-4-(3-hydroxypropyl)cyclohexanol |
5-(1,1-Dimethylheptyl)-2-5-hydroxy-2-(3-hydroxypropyl)cyclohexylphenol |
3HCP55940 |
Phenol,5-(1,1-dimethylheptyl)-2-(1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl-, rel-(-)- |
SR-01000075740 |
CP 56667 |
CP-56,667 |
5-(1,1-Dimethylheptyl)-2-(5-hydroxy-2-(3-hydroxypropyl)cyclohexyl)phenol |
2-((1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl)-5-(2-methyloctan-2-yl)phenol |
9GF |
Lopac-C-1112 |
Lopac0_000189 |
GTPL730 |
GTPL734 |
ChEMBL_75020 |
MLS002153159 |
CHEMBL48552 |
SCHEMBL120410 |
CHEMBL559612 |
DTXSID401017713 |
HMS2236E04 |
HMS3649D17 |
ZINC2568244 |
BDBM50072775 |
NSC792743 |
PDSP2_000199 |
PDSP2_000671 |
AKOS024458710 |
CCG-204284 |
LP00189 |
NSC-792743 |
SDCCGSBI-0050177.P002 |
(-)-cis-3-2-Hydroxy-4-(1,1-dimethylheptyl)phenyl-trans-4-(3-hydroxypropyl)cyclohexanol |
NCGC00015212-01 |
NCGC00024896-02 |
NCGC00024896-03 |
NCGC00024896-04 |
NCGC00024896-05 |
Phenol, 5-(1,1-dimethylheptyl)-2-((1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl)-, rel- |
Phenol, 5-(1,1-dimethylheptyl)-2-(5-hydroxy-2-(3-hydroxypropyl)cyclohexyl)-, (1alpha,2beta,5alpha)- |
SMR001230653 |
CP-55940 (-)-AC,XIV |
CP-55940, >98% (HPLC), powder |
EU-0100189 |
(?)-CP-55940 |
(A+/-)-CP 55,940 |
C 1112 |
(+-)-CP 55940 |
SR-01000597481 |
SR-01000075740-1 |
SR-01000075740-4 |
SR-01000597481-1 |
UNII-8YX8JK1BQG component YNZFFALZMRAPHQ-SYYKKAFVSA-N |
(1r,3r,4r)-3-2-hydroxy-4-(1,1-dimethylheptyl)phenyl-4-(3-hydroxypropyl)cyclohexan-1-ol |
5-(1,1-Dimethyl-heptyl)-2-(1R,2R,5R)-5-hydroxy-2-(3-hydroxy-propyl)-cyclohexyl-phenol |
rel-5-(1,1-dimethylheptyl)-2-(1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohexyl-phenol |
5-(1,1-Dimethyl-heptyl)-2-(4R,6R)-5-hydroxy-2-((R)-3-hydroxy-propyl)-cyclohexyl-phenol |
Experimental Data
CP55940
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33.000000000000000 | umol/L | -1.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
CP55940
Statistics Data
CP55940
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -1.000000000000000 | 1 | 1 |
Statistics Data Visualization
CP55940
