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24-Methylcholesta-5,7-dien-3-beta-ol

PubChem CID: 131750967

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Compound Synonyms 5,7-Ergostadien-3beta -ol, Ergosta-5,7-dien-3beta -ol, laquo deltaRaquo 5,7-Ergostadienol, 24-Methylcholesta-5,7-dien-3beta-ol, 24-Methylcholesta-5,7-dien-3-beta -ol, 24S-Methylcholesta-5,7-dien-3beta -ol, laquo deltaRaquo 5,7-Ergostadien-3beta -ol
Topological Polar Surface Area 20.2
Hydrogen Bond Donor Count 1.0
Inchi Key LATVVKIIEPSSHS-UHFFFAOYSA-N
Rotatable Bond Count 5.0
State Solid
Synonyms &laquo, DELTA&raquo, 5,7-Ergostadien-3&beta, -ol, &laquo, delta&raquo, 5,7-Ergostadienol, 22,23-Dihydroergosterol, 22,23-Dihydroergosterol, non-irradiated, 24-Methylcholesta-5,7-dien-3-&beta, -ol, 24-Methylcholesta-5,7-dien-3-beta -ol, 24-Methylcholesta-5,7-dien-3beta-ol, 24S-Methylcholesta-5,7-dien-3&beta, -ol, 24S-Methylcholesta-5,7-dien-3beta -ol, 5,7-Ergostadien-3&beta, -ol, 5,7-Ergostadien-3beta -ol, 5,7-Ergostadienol, Dihydroergosterol, Ergosta-5,7-dien-3-ol, Ergosta-5,7-dien-3&beta, -ol, Ergosta-5,7-dien-3beta -ol, Ergosta-5,7-dien-3beta-ol, Laquo deltaraquo 5,7-ergostadien-3beta -ol, Laquo deltaraquo 5,7-ergostadienol, Provitamin D4, Provitamin D7
Heavy Atom Count 29.0
Compound Name 24-Methylcholesta-5,7-dien-3-beta-ol
Kingdom Organic compounds
Description Constituent of seed oil of Vitis vinifera (wine grape). 22,23-Dihydroergosterol is found in many foods, some of which are common wheat, fruits, alcoholic beverages, and common mushroom.
Exact Mass 398.355
Formal Charge 0.0
Monoisotopic Mass 398.355
Isotope Atom Count 0.0
Molecular Complexity 672.0
Hydrogen Bond Acceptor Count 1.0
Molecular Weight 398.7
Database Name fooddb_chem_all;hmdb_chem_all;pubchem
Covalent Unit Count 1.0
Defined Atom Stereocenter Count 0.0
Iupac Name 17-(4,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Total Atom Stereocenter Count 8.0
Total Bond Stereocenter Count 0.0
Class Steroids and steroid derivatives
Inchi InChI=1S/C28H46O/c1-18(2)15-19(3)16-20(4)24-9-10-25-23-8-7-21-17-22(29)11-13-27(21,5)26(23)12-14-28(24,25)6/h7-8,18-20,22,24-26,29H,9-17H2,1-6H3
Smiles CC(C)CC(C)CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C
Xlogp 8.2
Superclass Lipids and lipid-like molecules
Defined Bond Stereocenter Count 0.0
Subclass Cholestane steroids
Taxonomy Direct Parent Cholesterols and derivatives
Molecular Formula C28H46O

  • 1. Outgoing r'ship FOUND_IN to/from Triticum Aestivum (Plant) Rel Props:Source_db:fooddb_chem_all