beta-calacorene (Q67879717)

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chemical compound

• β-calacorene

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Language	Label	Description	Also known as
English	beta-calacorene	chemical compound	β-calacorene

Statements

instance of

type of chemical entity

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subclass of

cadinane sesquiterpenoid

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chemical structure

Beta-Calacorene.svg
330 × 340; 8 KB

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mass

200.15650064 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₅H₂₀

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canonical SMILES

CC1=CC2=C(C=C1)C(=C)CCC2C(C)C

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found in taxon

Pilocarpus riedelianus

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stated in

Sesquiterpenos do caule de Pilocarpus riedelianus e atividades sobre microorganismos

Cryptomeria japonica

1 reference

stated in

THE ESSENTIAL OIL OF SUGI (Cryptomeria japonica) LEAVES.

Croton eluteria

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stated in

The constituents of cascarilla oil (croton eluteria bennett)

Hamamelis virginiana

1 reference

stated in

Study on the composition of the volatile fraction of Hamamelis virginiana

Daniellia oliveri

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stated in

Aromatic Plants from Tropical West Africa. II. Volatile Constituents ofDaniellia oliveri(Rolfe) Hutch & Dalz. from Benin and Burkina Faso

Mastigophora diclados

1 reference

stated in

Sesquiterpene constituents of the liverwort Calypogeia fissa

Myrcia tricona

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stated in

Two chromene derivatives from Calyptranthes tricona

Teucrium polium

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stated in

Volatile Constituents of Teucrium polium

Identifiers

InChI

InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9-10,13H,4,6,8H2,1-3H3

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InChIKey

KFYISTOZYAKAPV-UHFFFAOYSA-N

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PubChem CID

529621

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matched by identifier from

InChIKey

InChIKey

KFYISTOZYAKAPV-UHFFFAOYSA-N

ChEBI ID

230232

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9-10,13H,4,6,8H2,1-3H3

UniChem compound ID

25581362

1 reference

stated in

UniChem

DSSTox substance ID

DTXSID301037398

1 reference

matched by identifier from

InChIKey

InChIKey

KFYISTOZYAKAPV-UHFFFAOYSA-N

Human Metabolome Database ID

HMDB0059858

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

KFYISTOZYAKAPV-UHFFFAOYSA-N

 

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