Chemical ID: 4332023

CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)CO)C)C(C)C
Chemical ID:
4332023
Name [?]:
17-(4-ethyl-1,5-dimethyl-hexyl)-10-(hydroxymethyl)-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SMILES [?]:
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)CO)C)C(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C29H50O2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:9
ZAP Information [?]
Total:13.3918
Area:636.052
Solvation:-2.50947
Coulombic:-39.0791
Bond Count [?]
All:34
Single:33
Double:1
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:430.706
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:7.51
LogP (Chemaxon):6.9

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue