(Q105021731)

English

(1R,4Z,9S)-4-(hydroxymethyl)-11,11-dimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one

chemical compound

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Statements

type of chemical entity

0 references

4-(Hydroxymethyl)-11,11-dimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one

1 reference

based on heuristic

inferred from SMILES

234.161979944 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,4E,9S)-4-(hydroxymethyl)-11,11-dimethyl-8-methylidenebicyclo[7.2.0]undec-4-en-3-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₂O₂

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canonical SMILES

O=C1C(=CCCC(=C)C2CC(C)(C)C2C1)CO

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isomeric SMILES

C=C1CC/C=C(/CO)C(=O)C[C@@H]2[C@@H]1CC2(C)C

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Pulicaria arabica

1 reference

Caryophyllene derivatives from Pulicaria arabica

Pulicaria scabra

1 reference

Caryophyllane derivatives from Pulicaria scabra

Identifiers

InChI=1S/C15H22O2/c1-10-5-4-6-11(9-16)14(17)7-13-12(10)8-15(13,2)3/h6,12-13,16H,1,4-5,7-9H2,2-3H3/b11-6-/t12-,13-/m1/s1

0 references

GVUHIWDAWNDBKR-RLLAQXBXSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

mapping relation type

2 references

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI=1S/C15H22O2/c1-10-5-4-6-11(9-16)14(17)7-13-12(10)8-15(13,2)3/h6,12-13,16H,1,4-5,7-9H2,2-3H3/b11-6-/t12-,13-/m1/s1

UniChem compound ID

1 reference

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