Identification

PhytoHub ID
PHUB000472
Name
Campesterol
Systematic Name
Not Available
Synonyms
  • Campesterin
CAS Number
Not Available
Average Mass
400.691
Monoisotopic Mass
400.370516166
Chemical Formula
C28H48O
IUPAC Name
campesterol
InChI Key
SGNBVLSWZMBQTH-RWVZYBNDNA-N
InChI Identifier
InChI=1/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20-,22+,23+,24-,25+,26+,27+,28-/s2
SMILES
[H][[email protected]@]1(CC[[email protected]@]2([H])[[email protected]]3([H])CC=C4C[[email protected]@H](O)CC[[email protected]]4(C)[[email protected]@]3([H])CC[[email protected]]12C)[[email protected]](C)CC[[email protected]@H](C)C(C)C
Structure

Calculated Properties

Solubility (ALOGPS)
2.19e-05 g/l
LogS (ALOGPS)
-7.26
LogP (ALOGPS)
6.81
Hydrogen Acceptors
1
Hydrogen Donors
1
Rotatable Bond Count
5
Polar Surface Area
20.23
Refractivity
125.16509999999997
Polarizability
52.25560278368588
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-1.397243770292629
pKa (strongest acidic)
18.20428950550382
Number of Rings
4
Rule of Five
No
Bioavailability
Yes
Ghose Filter
No
Veber's Rule
Yes
MDDR-like Rule
No

Taxonomy

Family
Terpenoids
Class
Phytosterols
Sub-class
Not Available

Spectra

Record IDSourceDescriptionView
JP005750MassBankEI-B Spectrum - -, [M]+*View Spectra

Food Sources

NameGroup
AlfalfaHerbs and Spices PublicationsShow
AlmondNuts PublicationsShow
AppleFruit, Pomes PublicationsShow
ApricotFruit, Drupes PublicationsShow
AvocadoVegetables, Fruit vegetables PublicationsShow
BananaFruit, Tropical fruits PublicationsShow
BarleyCereals and cereal products PublicationsShow
BlackcurrantFruit, Berries PublicationsShow
Brazil nutNuts PublicationsShow
BroccoliVegetables, Cabbages PublicationsShow
Brussel sproutsVegetables, Cabbages PublicationsShow
CarrotVegetables, Root vegetables PublicationsShow
Cashew nutNuts PublicationsShow
CauliflowerVegetables, Cabbages PublicationsShow
ChocolateCocoa and cocoa products PublicationsShow
Common beanPulses and beans PublicationsShow
Common beetrootVegetables, Root vegetables PublicationsShow
Common cabbageVegetables, Cabbages PublicationsShow
Common hazelnutNuts PublicationsShow
Common peaPulses and beans PublicationsShow
Common walnutNuts PublicationsShow
Common wheatCereals and cereal products PublicationsShow
CornCereals and cereal products PublicationsShow
DillHerbs and Spices PublicationsShow
European plumFruit, Drupes PublicationsShow
FlaxseedOilseed crops PublicationsShow
GrapeFruit, Berries PublicationsShow
KiwiFruit, Tropical fruits PublicationsShow
LeekVegetables, Onion-family PublicationsShow
LettuceVegetables, Leaf vegetables PublicationsShow
Macadamia nutNuts PublicationsShow
OatCereals and cereal products PublicationsShow
OnionVegetables, Onion-family PublicationsShow
Orange juiceBeverages, Non-alcoholic PublicationsShow
ParsleyHerbs and Spices PublicationsShow
Passion fruitFruit, Tropical fruits PublicationsShow
PeanutNuts PublicationsShow
Pecan nutNuts PublicationsShow
PepperHerbs and Spices PublicationsShow
Pine nutNuts PublicationsShow
PistachioNuts PublicationsShow
PoppyOilseed crops PublicationsShow
PotatoVegetables, Tubers PublicationsShow
RapeseedOilseed crops PublicationsShow
RedcurrantFruit, Berries PublicationsShow
RyeCereals and cereal products PublicationsShow
SesameOilseed crops PublicationsShow
Soy beanSoy and soy products PublicationsShow
SpinachVegetables, Leaf vegetables PublicationsShow
StrawberryFruit, Berries PublicationsShow
SunflowerOilseed crops PublicationsShow
Swede (Rutabaga)Vegetables, Root vegetables PublicationsShow
Sweet orangeFruit, Citrus PublicationsShow
TomatoVegetables, Fruit vegetables PublicationsShow
Vaccinium (Blueberry, Cranberry, Huckleberry)Fruit, Berries PublicationsShow

Metabolism

No metabolism information available

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