CINERIN II

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H28O5
Molecular Weight	360.444
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of CINERIN II

Structure Search

SMILES

COC(=O)C(\C)=C\[C@@H]1[C@@H](C(=O)O[C@H]2CC(=O)C(C\C=C/C)=C2C)C1(C)C

InChI

InChIKey=SHCRDCOTRILILT-WOBDGSLYSA-N

InChI=1S/C21H28O5/c1-7-8-9-14-13(3)17(11-16(14)22)26-20(24)18-15(21(18,4)5)10-12(2)19(23)25-6/h7-8,10,15,17-18H,9,11H2,1-6H3/b8-7-,12-10+/t15-,17+,18+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

CINERIN II

Common Name

English

CINERIN 2

Common Name

English

CINERIN II [MI]

Common Name

English

CINERIN II [ISO]

Common Name

English

CINERIN II [HSDB]

Common Name

English

3-(3-METHOXY-2-METHYL-3-OXO-1-PROPENYL)-2,2-DIMETHYLCYCLOPROPANECARBOXYLIC ACID 3-(2-BUTENYL)-2-METHYL-4-OXO-2- CYCLOPENTEN-1-YL ESTER

Systematic Name

English

CYCLOPROPANECARBOXYLIC ACID, 3-((1E)-3-METHOXY-2-METHYL-3-OXO-1-PROPEN-1-YL)-2,2-DIMETHYL-, (1S)-3-(2Z)-2-BUTEN-1-YL-2-METHYL-4-OXO-2-CYCLOPENTEN-1- YL ESTER, (1R,3R)-

Common Name

English

3-(BUT-2-ENYL)-2-METHYL-4-OXOCYCLOPENT-2-ENYL-2,2-DIMETHYL-3-(3-METHOXY-2-METHYL-3-OXOPROP-1-ENYL)CYCLOPROPANECARBOXYLATE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C737

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

EPA PESTICIDE CODE

69010

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

Code System Code Type Description

NCI_THESAURUS

C80596

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

FDA UNII

J204A0Y0JG

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

CAS

121-20-0

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

CHEBI

3707

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

ECHA (EC/EINECS)

204-454-2

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

PUBCHEM

5281548

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

ALANWOOD

cinerin II

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

MERCK INDEX

m3563

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

Merck Index

EPA CompTox

DTXSID9041788

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

HSDB

6838

Created by admin on Fri Dec 15 14:58:42 GMT 2023 , Edited by admin on Fri Dec 15 14:58:42 GMT 2023

PRIMARY

SUBSTANCE RECORD


					J204A0Y0JG