NEOCEMBRENE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H32
Molecular Weight	272.4681
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of NEOCEMBRENE

Structure Search

SMILES

CC(=C)[C@@H]1CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\C1

InChI

InChIKey=VWSPQDDPRITBAM-KPGNMOGWSA-N

InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,20H,1,6-7,9-10,13-15H2,2-5H3/b17-8+,18-12+,19-11+/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H32
Molecular Weight	272.4681
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:59:13 GMT 2023` Edited by `admin` on `Sat Dec 16 08:59:13 GMT 2023`
Record UNII	2WGK4P4230
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NEOCEMBRENE

Common Name

English

NEOCEMBRENE A

Common Name

English

NSC-309918

Code

English

1,5,9-CYCLOTETRADECATRIENE, 1,5,9-TRIMETHYL-12-(1-METHYLETHENYL)-, (1E,5E,9E,12R)-

Systematic Name

English

CEMBRENE A

Common Name

English

(R)-(-)-CEMBRENE A

Common Name

English

NEOCEMBRENE [MI]

Common Name

English

Code System Code Type Description

PUBCHEM

5281384

Created by admin on Sat Dec 16 08:59:13 GMT 2023 , Edited by admin on Sat Dec 16 08:59:13 GMT 2023

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FDA UNII

2WGK4P4230

Created by admin on Sat Dec 16 08:59:13 GMT 2023 , Edited by admin on Sat Dec 16 08:59:13 GMT 2023

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WIKIPEDIA

Cembrene A

Created by admin on Sat Dec 16 08:59:13 GMT 2023 , Edited by admin on Sat Dec 16 08:59:13 GMT 2023

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CAS

31570-39-5

Created by admin on Sat Dec 16 08:59:13 GMT 2023 , Edited by admin on Sat Dec 16 08:59:13 GMT 2023

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EPA CompTox

DTXSID401317353

Created by admin on Sat Dec 16 08:59:13 GMT 2023 , Edited by admin on Sat Dec 16 08:59:13 GMT 2023

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MERCK INDEX

m7803

Created by admin on Sat Dec 16 08:59:13 GMT 2023 , Edited by admin on Sat Dec 16 08:59:13 GMT 2023

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Merck Index

NSC

309918

Created by admin on Sat Dec 16 08:59:13 GMT 2023 , Edited by admin on Sat Dec 16 08:59:13 GMT 2023

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CHEBI

82800

Created by admin on Sat Dec 16 08:59:13 GMT 2023 , Edited by admin on Sat Dec 16 08:59:13 GMT 2023

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