(Q55929359)

inferred from SMILES

mass

150.104465068 dalton

1 reference

2 references

inferred from InChIKey

(1R,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-one

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₁₀H₁₄O

0 references

canonical SMILES

O=C1C=C(C)C2CC1C2(C)C

0 references

isomeric SMILES

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

0 references

found in taxon

Cyperus rotundus

1 reference

Chemical composition, antiproliferative, antioxidant and antibacterial activities of essential oils from aromatic plants growing in Sudan

Teucrium leucocladum

1 reference

Chemical analysis and biological activities of the essential oil of Teucrium leucocladum Boiss. (Lamiaceae)

Artemisia baldshuanica

1 reference

A new melampolide and other secondary metabolites from Artemisia baldshuanica

Eucalyptus globulus

1 reference

Untersuchung der hochsiedenden Anteile des spanischen Eucalyptusöls von E. globulus

Identifiers

InChI

InChI=1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m1/s1

0 references

1 reference

ChEBI release 2020-09-01

CAS Registry Number

18309-32-5

1 reference

https://commonchemistry.cas.org/detail?cas_rn=18309-32-5

10 April 2021

PubChem CID

65724

1 reference

ChEBI ID

9955

mapping relation type

exact match

2 references

ChEBI release 2019-10-02

International Chemical Identifier

InChI

InChI=1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m1/s1

SureChEMBL ID

SCHEMBL3506768

2 references

inferred from InChIKey

1 reference

1 reference

DSSTOX compound identifier

0 references

0 references

242-195-7

0 references

ECHA Substance Infocard ID

100.038.344

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.038.344

retrieved

27 December 2018

title

(1R)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-one (English)

quotation

CAS no.: 18309-32-5 (English)

1 reference

28 December 2019

TRIMETHYLBICYCLO-3-HEPTEN-2-ONE (English)

quotation

CAS no.: 18309-32-5 (English)

1 reference

AICS Chemical ID (BEING DELETED)

14847

0 references

DrugBank ID

DB15977

1 reference

UNII

99S17893UW

1 reference

IFV46DXC6U

1 reference