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Ergosta-5,7,22,24(28)-tetraen-3beta-ol

  • Formula: C28H42O

  • Molecular weight: 394.60

  • Smiles: CC(C)C(=C)C=CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C

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Ergosta-5,7,22,24(28)-tetraen-3beta-ol

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
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Names

  • Mycotoxin name: Ergosta-5,7,22,24(28)-tetraen-3beta-ol

  • First synonym: Ergosta-5,7,22,24(28)-tetraen-3beta-ol

  • Synonyms: Ergosta-5,7,22,24(28)-tetraen-3beta-ol,24(28)-Dehydroergosterol,5,7,22,24(28)-Ergostatetraenol,Ergosta-5,7,22,24(24(1))-tetraen-3beta-ol,29560-24-5,(22E)-24-methylcholesta-5,7,22,24(24(1))-tetraen-3beta-ol,Ergosta-5,7,22,24(241)-tetraen-3beta-ol,ergosta-5,7,22E,24(28)-tetraen-3beta-ol,(3S,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(E,2R)-6-methyl-5-methylidenehept-3-en-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol,SCHEMBL4256617,SCHEMBL22361207,CHEBI:18249,LMST01031015,HY-130702,CS-0111437,ergosta-5,7,22,23(28)-tetraen-3beta-ol,(22E)-ergosta-5,7,22,24(28)-tetraen-3beta-ol,Q27102944

Identifiers / External links

Structure

  • Smiles: CC(C)C(=C)C=CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C

  • Isomeric smiles: C[C@H](/C=C/C(=C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)O)C)C

  • Inchi: InChI=1S/C28H42O/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/h7-10,18,20,22,24-26,29H,3,11-17H2,1-2,4-6H3/b8-7+/t20-,22+,24-,25+,26+,27+,28-/m1/s1

  • Inchikey: SQFQJKZSFOZDJY-CVGLIYDESA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C28H42O

  • Molecular weight: 394.60

  • Monoisotopic mass: 394.323565959

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