(Q105107171)

English

[(3S,4S,6R)-4-bromo-10-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-9-en-3-yl] acetate

chemical compound

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instance of

type of chemical entity

0 references

subclass of

2-bromo-8-chloro-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-yl acetate

1 reference

based on heuristic

inferred from SMILES

mass

374.064819788 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

[(3S,4R,6S)-4-bromo-10-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-9-en-3-yl] acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₄BrClO₂

0 references

canonical SMILES

O=C(OC1CC(=C)C2(CC(Cl)=C(C)CC2)C(C)(C)C1Br)C

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isomeric SMILES

C=C1C[C@H](OC(C)=O)[C@@H](Br)C(C)(C)[C@@]12CCC(C)=C(Cl)C2

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found in taxon

Aplysia dactylomela

2 references

stated in

Cytotoxic sesquiterpenes from Aplysia dactylomela.

stated in

Cytotoxic sesquiterpenes from Aplysia dactylomela.

Identifiers

InChI

InChI=1S/C17H24BrClO2/c1-10-6-7-17(9-13(10)19)11(2)8-14(21-12(3)20)15(18)16(17,4)5/h14-15H,2,6-9H2,1,3-5H3/t14-,15+,17+/m0/s1

0 references

InChIKey

GQCHYEJJCOTYBA-ZMSDIMECSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GQCHYEJJCOTYBA-ZMSDIMECSA-N

1 reference

(Q105107171)

[(3S,4S,6R)-4-bromo-10-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-9-en-3-yl] acetate

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