(Q105031072)

English

(3S,6S,7aR)-6-bromo-5,5-dimethyl-3,6,7,7a-tetrahydro-2H-1-benzofuran-3-ol

chemical compound

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No label defined

No description defined

Statements

type of chemical entity

0 references

6-bromo-5,5-dimethyl-3,6,7,7a-tetrahydro-2H-1-benzofuran-3-ol

1 reference

based on heuristic

inferred from SMILES

246.02554182 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,6S,7aR)-6-bromo-5,5-dimethyl-3,6,7,7a-tetrahydro-2H-1-benzofuran-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,6R,7aS)-6-bromo-5,5-dimethyl-3,6,7,7a-tetrahydro-2H-1-benzofuran-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R,6R,7aS)-6-bromo-5,5-dimethyl-3,6,7,7a-tetrahydro-2H-1-benzofuran-3-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₀H₁₅BrO₂

0 references

canonical SMILES

BrC1CC2OCC(O)C2=CC1(C)C

0 references

isomeric SMILES

CC1(C)C=C2[C@H](O)CO[C@@H]2C[C@@H]1Br

0 references

Ochtodes crockeri

1 reference

Cyclic monoterpenoid feeding deterrents from the red marine alga Ochtodes crockeri

Identifiers

InChI=1S/C10H15BrO2/c1-10(2)4-6-7(12)5-13-8(6)3-9(10)11/h4,7-9,12H,3,5H2,1-2H3/t7-,8-,9+/m1/s1

0 references

HNULJAOABSCBIT-HLTSFMKQSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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