(Q105116129)

English

24-Methylenecholoesterol

group of stereoisomers with the chemical formula C₂₈H₄₆O

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Statements

group of stereoisomers

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ergostane steroid

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ergostane steroid

398.354866092 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₈H₄₆O

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canonical SMILES

OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCC(=C)C(C)C)C2(C)CC1

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isomeric SMILES

C=C(CC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C)C(C)C

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Identifiers

InChI=1S/C28H46O/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,3,7-8,10-17H2,1-2,4-6H3/t20-,22+,23?,24-,25?,26?,27+,28-/m1/s1

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INDVLXYUCBVVKW-BKGFLPDPSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

INDVLXYUCBVVKW-BKGFLPDPSA-N

UniChem compound ID

1 reference

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