UCSF

ZINC04095717

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 30 No

Popular Name: beta-Sitosterol beta-Sitosterol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 64997-52-0 , 68441-03-2 , 83-46-5 , [83-46-5]

Other Names:

(-)-b-Sitosterol;(-)-beta-Sitosterol;(24R)-Ethylcholest-5-en-3b-ol;(24R)-Stigmast-5-en-3b-ol;22,23-Dihydro-Stigmasterol;22,23-Dihydrostigmasterol;24a-Ethylcholesterol;a-Dihydrofucosterol;a-Phytosterol;alpha-Dihydrofucosterol;alpha-Phytosterol;Angelicin;Az

(-)-beta-Sitosterol; (24R)-Ethylcholest-5-en-3beta-ol; (24R)-Stigmast-5-en-3beta-ol; (3beta)-Stigmast-5-en-3-ol; 22,23-Dihydrostigmasterol; 24alpha-Ethylcholesterol; 24beta-Ethylcholesterol; Angelicin; Azuprostat; Cinchol; Cupreol; Harzol; Nimbosterol; Ph

(3beta)-stigmast-5-en-3-ol; .alpha.-Dihydrofucosterol; .beta.-Sitosterin; .beta.-Sitosterol; 22,23-Dihydrostigmasterol; 24.alpha.-Ethylcholesterol; 24beta-Ethylcholesterol; 5-Stigmasten-3beta-ol; Angelicin; Angelicin (steroid); Cinchol; Cupreol; Harzol; Q

22,23-Dihydrostigmasterol

24-Ethylcholest-5-en-3beta-ol; 24-ethylcholest-5-en-3 beta-ol; 24-ethylcholesterol; 3beta-sitosterol; 3beta-stigmast-5-en-3-ol; C30H50O; Harzol; LS-175879; NSC 8096; Stigmast-5-en-3-ol; Stigmast-5-en-3-ol, (3beta)-; beta-sitosterol; clionasterol; sitoster

5-Stigmasten-3beta-ol

83-46-5; C01753; Sitosterol; beta-Sitosterol

83-46-5; D08518; Harzol (TN); beta-Sitosterol

alfa-Dihydrofucosterol

B-Sitosterol

b-Sitosterol [83-46-5]

beta-Sitosterol (contains Campesterol)

beta-Sitosterol, 95%+

beta-Sitosterol, Technical grade

beta-Sitosterol, with ca. 10% campesterol, ca. 75% beta-sitosterol

beta-Sitosterol; 22,23-Dihydrostigmasterol; b-Sitosterol

beta-SITOSTEROL; [83-46-5]

CHEBI:26692; CHEBI:9170

CPD-4143; sitosterol

EINECS 271-413-3; LS-195633; Refined soy sterol; Soybean oil sterols phytosterols; Steroids, hydroxy

MFCD00003631

N/A

Phytosterol

Phytosterols

sitosterol

Sitosterol;?-Sitosterol

stigmast-5-en-3-ol

stigmast-5-en-3-ol, (3b)-

stigmast-5-en-3-ol, (3b,24R)-

stigmast-5-en-3beta-ol

¦Â-Sitosterol

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 8.62 13.65 -1.48 1 1 0 20 414.718 6 ↓

Vendor Notes

Note Type Comments Provided By
MP 136-140 °C(lit.) Indofine
Mp [°C] 139 - 142 Acros Organics
MP 139-140o C Indofine
MP 140 TCI
UniProt Database Links ANGS_PASSA; CP6B3_PAPPO; CP6B4_PAPGL; DIM_ARATH; LCAT2_ARATH; NPCL1_MOUSE; ORP3A_ARATH; SC5D1_ARATH; SC5D_TOBAC; U80A2_ARATH; U80B1_ARATH; UGT52_DICDI ChEBI
SOLUBILITY chloroform: 20 mg/mL, clear, colorless Indofine
Patent Database Links EP1525882; EP1600062; EP1616562; EP1652512; EP1652513; EP1693376; EP1806350; EP1810694; EP1834628; EP1985308; US2002098152; US2003120095; US2003195178; US2005019386; US2005033027; US2006240077; US2007196440; US2007249574; US2007254026; US2008070981; WO200 ChEBI
Target Others Selleck Chemicals
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
SOLUBILITY Soluble in Hexane/ethylacetate Indofine

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )