.BETA.-CARYOPHYLLENE OXIDE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H24O
Molecular Weight	220.3505
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-CARYOPHYLLENE OXIDE

Structure Search

SMILES

[H][C@]12CC(C)(C)[C@]1([H])CC[C@@]3(C)O[C@@H]3CCC2=C

InChI

InChIKey=NVEQFIOZRFFVFW-RGCMKSIDSA-N

InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3/t11-,12-,13-,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H24O
Molecular Weight	220.3505
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:09:57 UTC 2023` Edited by `admin` on `Fri Dec 15 17:09:57 UTC 2023`
Record UNII	S2XU9K448U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-CARYOPHYLLENE OXIDE

Common Name

English

4.BETA.,5.ALPHA.-EPOXYCARYOPHYLLENE

Common Name

English

(-)CAROPHYLLENE OXIDE

Common Name

English

5-OXATRICYCLO(8.2.0.04,6)DODECANE, 4,12,12-TRIMETHYL-9-METHYLENE-, (1R-(1R*,4R*,6R*,10S*))-

Common Name

English

CARYOPHYLLENE OXIDE

Common Name

English

TRANS-CARYOPHYLLENE OXIDE

Common Name

English

CARYOPHYLLENE, EPOXIDE

Common Name

English

CARYOPHYLLENE 4.BETA.,5.ALPHA.-OXIDE

Common Name

English

4-12,12-TRIMETHYL-9-METHYLENE-5-OXATRICYLO (8.2.0.04,6) DODECANE

Common Name

English

(-)-.BETA.-CARYOPHYLLENE EPOXIDE

Common Name

English

CARYOPHYLLENE 4.BETA.,5.ALPHA.-EPOXIDE

Common Name

English

FEMA NO. 4085

Code

English

(-)-BETA-CARYOPHYLLENE EPOXIDE [HSDB]

Common Name

English

.BETA.-CARYOPHYLLENE OXIDE [FHFI]

Common Name

English

5-OXATRICYCLO(8.2.0.04,6)DODECANE, 4,12,12-TRIMETHYL-9-METHYLENE-, (1R,4R,6R,10S)-

Systematic Name

English

(-)-CARYOPHYLLENE OXIDE

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

BETA-CARYOPHYLLENE OXIDE

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

CFR

21 CFR 172.515

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

Code System Code Type Description

CAS

1139-30-6

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

CAS

52209-95-7

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

SUPERSEDED

ECHA (EC/EINECS)

214-519-7

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

MESH

C515179

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

HSDB

5466

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

PUBCHEM

1742210

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

EPA CompTox

DTXSID4051586

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

JECFA MONOGRAPH

1565

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

CAS

32095-03-7

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

SUPERSEDED

CAS

11023-55-5

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

SUPERSEDED

RXCUI

2395801

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

CAS

105120-46-5

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

SUPERSEDED

DAILYMED

S2XU9K448U

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

FDA UNII

S2XU9K448U

Created by admin on Fri Dec 15 17:09:57 UTC 2023 , Edited by admin on Fri Dec 15 17:09:57 UTC 2023

PRIMARY

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