.ALPHA.-CIS-BERGAMOTENE

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H24
Molecular Weight	204.3511
Optical Activity	( + / - )
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=YMBFCQPIMVLNIU-KKUMJFAQSA-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

HIDE SMILES / InChI

Molecular Formula	C15H24
Molecular Weight	204.3511
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:34:20 GMT 2023` Edited by `admin` on `Fri Dec 15 17:34:20 GMT 2023`
Record UNII	VTF86SPQ4S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-CIS-BERGAMOTENE

Common Name

English

CIS-.ALPHA.-BERGAMOTENE

Common Name

English

2-NORPINENE, 2,6-DIMETHYL-6-(4-METHYL-3-PENTENYL)-, CIS-

Systematic Name

English

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

Systematic Name

English

Code System Code Type Description

FDA UNII

VTF86SPQ4S

Created by admin on Fri Dec 15 17:34:20 GMT 2023 , Edited by admin on Fri Dec 15 17:34:20 GMT 2023

PRIMARY

PUBCHEM

6429303

Created by admin on Fri Dec 15 17:34:20 GMT 2023 , Edited by admin on Fri Dec 15 17:34:20 GMT 2023

PRIMARY

CAS

18252-46-5

Created by admin on Fri Dec 15 17:34:20 GMT 2023 , Edited by admin on Fri Dec 15 17:34:20 GMT 2023

PRIMARY

EPA CompTox

DTXSID501037120

Created by admin on Fri Dec 15 17:34:20 GMT 2023 , Edited by admin on Fri Dec 15 17:34:20 GMT 2023

PRIMARY

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Comments:

Sesquiterpene Class

Amount: