(Q82804974)

English

(5R,8S)-5-Methyl-8-(6-methylhept-5-en-2-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid

chemical compound

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instance of

type of chemical entity

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subclass of

5-Methyl-8-(6-methylhept-5-en-2-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

300.208930136 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₈O₂

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canonical SMILES

O=C(O)C1=CC=C2C(=C1)C(CCC2C)C(C)CCC=C(C)C

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isomeric SMILES

CC(C)=CCC[C@H](C)[C@@H]1CC[C@@H](C)c2ccc(C(=O)O)cc21

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found in taxon

Eremophila duttonii

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stated in

Antimicrobial compounds from the Australian desert plant Eremophila neglecta

Eremophila sturtii

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stated in

Bactericidal and cyclooxygenase inhibitory diterpenes from Eremophila sturtii

Identifiers

InChI

InChI=1S/C20H28O2/c1-13(2)6-5-7-14(3)17-10-8-15(4)18-11-9-16(20(21)22)12-19(17)18/h6,9,11-12,14-15,17H,5,7-8,10H2,1-4H3,(H,21,22)/t14-,15+,17-/m0/s1

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InChIKey

ODZQBEPDXUFJRX-UXLLHSPISA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

ODZQBEPDXUFJRX-UXLLHSPISA-N

1 reference

1 reference

matched by identifier from

InChIKey

ODZQBEPDXUFJRX-UXLLHSPISA-N

DSSTOX compound identifier

DTXCID30773194

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(Q82804974)

(5R,8S)-5-Methyl-8-(6-methylhept-5-en-2-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid

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Identifiers

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