(Q105028997)

English

3beta,5beta-Dichloro-4,4-dimethyl-6-(2-chloroethylidene)cyclohexene

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3,5-Dichloro-6-(2-chloroethylidene)-4,4-dimethylcyclohexene

1 reference

based on heuristic

inferred from SMILES

mass

238.008283456 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₀H₁₃Cl₃

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canonical SMILES

ClCC=C1C=CC(Cl)C(C)(C)C1Cl

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isomeric SMILES

CC1(C)[C@@H](Cl)/C(=C/CCl)C=C[C@H]1Cl

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found in taxon

Portieria hornemannii

2 references

stated in

A pentahalogenated monoterpene from the red alga Portieria hornemannii produces a novel cytotoxicity profile against a diverse panel of human tumor cell lines

stated in

Isolation and structure/activity features of halomon-related antitumor monoterpenes from the red alga Portieria hornemannii

Identifiers

InChI

InChI=1S/C10H13Cl3/c1-10(2)8(12)4-3-7(5-6-11)9(10)13/h3-5,8-9H,6H2,1-2H3/b7-5+/t8-,9+/m1/s1

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InChIKey

HISRQLKATUAPCT-FQDVODHFSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HISRQLKATUAPCT-FQDVODHFSA-N

1 reference

(Q105028997)

3beta,5beta-Dichloro-4,4-dimethyl-6-(2-chloroethylidene)cyclohexene

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