Isoacorone

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H24O2
Molecular Weight	236.3499
Optical Activity	( - )
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Isoacorone

Structure Search

SMILES

CC(C)[C@H]1C(=O)C[C@H](C)[C@@]12CC[C@H](C)C(=O)C2

InChI

InChIKey=AGUISGUERLMHFF-GVARAGBVSA-N

InChI=1S/C15H24O2/c1-9(2)14-12(16)7-11(4)15(14)6-5-10(3)13(17)8-15/h9-11,14H,5-8H2,1-4H3/t10-,11-,14-,15-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

NSC-147746

Preferred Name

English

Isoacorone

Common Name

English

Spiro[4.5]decane-2,7-dione, 4,8-dimethyl-1-(1-methylethyl)-,(1R,4S,5S,8S)-

Systematic Name

English

(-)-Isoacorone

Common Name

English

Code System Code Type Description

NSC

147746

Created by admin on Wed Apr 02 20:52:14 GMT 2025 , Edited by admin on Wed Apr 02 20:52:14 GMT 2025

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FDA UNII

JXC4LT8GCA

Created by admin on Wed Apr 02 20:52:14 GMT 2025 , Edited by admin on Wed Apr 02 20:52:14 GMT 2025

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CAS

6168-64-5

Created by admin on Wed Apr 02 20:52:14 GMT 2025 , Edited by admin on Wed Apr 02 20:52:14 GMT 2025

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EPA CompTox

DTXSID601318383

Created by admin on Wed Apr 02 20:52:14 GMT 2025 , Edited by admin on Wed Apr 02 20:52:14 GMT 2025

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PUBCHEM

11402120

Created by admin on Wed Apr 02 20:52:14 GMT 2025 , Edited by admin on Wed Apr 02 20:52:14 GMT 2025

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SUBSTANCE RECORD


					JXC4LT8GCA