.ALPHA.-BERGAMOTENE, (E)-(-)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H24
Molecular Weight	204.3511
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .ALPHA.-BERGAMOTENE, (E)-(-)-

SMILES

CC(C)=CCC[C@]1(C)[C@@H]2C[C@H]1C(C)=CC2

InChI

InChIKey=YMBFCQPIMVLNIU-SOUVJXGZSA-N

InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6-7,13-14H,5,8-10H2,1-4H3/t13-,14-,15+/m0/s1

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Approval Year

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Name

Type

Language

.ALPHA.-BERGAMOTENE, (E)-(-)-

Common Name

English

(-)-EXO-.ALPHA.-BERGAMOTENE

Preferred Name

English

BICYCLO(3.1.1)HEPT-2-ENE, 2,6-DIMETHYL-6-(4-METHYL-3-PENTEN-1-YL)-, (1S,5S,6R)-

Systematic Name

English

BICYCLO(3.1.1)HEPT-2-ENE, 2,6-DIMETHYL-6-(4-METHYL-3-PENTENYL)-, (1S-(1.ALPHA.,5.ALPHA.,6.ALPHA.))-

Common Name

English

(-)-TRANS-.ALPHA.-BERGAMOTENE

Common Name

English

Showing 1 to 5 of 12 entries

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Code System

Code

Type

Description

FDA UNII

599TK2712C

PRIMARY

EPA CompTox

DTXSID901017570

PRIMARY

PUBCHEM

6429302

PRIMARY

CAS

13474-59-4

PRIMARY

Showing 1 to 4 of 4 entries

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SUBSTANCE RECORD


					599TK2712C

.ALPHA.-BERGAMOTENE, (E)-(-)-