(Q82878023)

English

7-Ethynyl-8a,10a-dimethylhexadecahydrodicyclopenta[a,f]naphthalene-1,7-diol

group of stereoisomers with the chemical formula C₂₀H₃₀O₂

In more languages

Statements

group of stereoisomers

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chemical compound

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302.2245802 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₂

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based on heuristic

inferred from SMILES

canonical SMILES

C#CC1(O)CC2CCC3C4CCC(O)C4(C)CCC3C2(C)C1

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C#C[C@@]1(O)CC2CCC3C(CCC4(C)C3CC[C@@H]4O)C2(C)C1

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C20H30O2/c1-4-20(22)11-13-5-6-14-15-7-8-17(21)18(15,2)10-9-16(14)19(13,3)12-20/h1,13-17,21-22H,5-12H2,2-3H3/t13?,14?,15?,16?,17-,18?,19?,20+/m0/s1

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KSJJQCZCDJYYDJ-RZOQUZGISA-N

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CAS Registry Number

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1 reference

26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

DTXCID201337678

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