BETA-GURJUNENE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H24
Molecular Weight	204.3511
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BETA-GURJUNENE

Structure Search

SMILES

[H][C@]12CCC(=C)[C@@]1([H])[C@H]3[C@@H](CC[C@H]2C)C3(C)C

InChI

InChIKey=IRCZVRWQUNZGSH-DKTYCGPESA-N

InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h9,11-14H,2,5-8H2,1,3-4H3/t9-,11-,12-,13-,14-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H24
Molecular Weight	204.3511
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:12:03 GMT 2023` Edited by `admin` on `Sat Dec 16 08:12:03 GMT 2023`
Record UNII	U3RZ4VEY86
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BETA-GURJUNENE

Common Name

English

1H-CYCLOPROP(E)AZULENE, DECAHYDRO-1,1,4-TRIMETHYL-7-METHYLENE-, (1AR,4R,4AR,7AR,7BR)-

Systematic Name

English

(1AR,4R,4AR,7AR,7BR)-DECAHYDRO-1,1,4-TRIMETHYL-7-METHYLENE-1H-CYCLOPROP(E)AZULENE

Systematic Name

English

Code System Code Type Description

FDA UNII

U3RZ4VEY86

Created by admin on Sat Dec 16 08:12:03 GMT 2023 , Edited by admin on Sat Dec 16 08:12:03 GMT 2023

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EPA CompTox

DTXSID40994212

Created by admin on Sat Dec 16 08:12:03 GMT 2023 , Edited by admin on Sat Dec 16 08:12:03 GMT 2023

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CHEBI

80940

Created by admin on Sat Dec 16 08:12:03 GMT 2023 , Edited by admin on Sat Dec 16 08:12:03 GMT 2023

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PUBCHEM

6450812

Created by admin on Sat Dec 16 08:12:03 GMT 2023 , Edited by admin on Sat Dec 16 08:12:03 GMT 2023

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CAS

73464-47-8

Created by admin on Sat Dec 16 08:12:03 GMT 2023 , Edited by admin on Sat Dec 16 08:12:03 GMT 2023

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