U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H32O2
Molecular Weight 292.4562
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GUAIYL BUTYRATE

SMILES

CCCC(=O)OC(C)(C)[C@@H]1CC[C@H](C)C2=C(C1)[C@@H](C)CC2

InChI

InChIKey=FZRQHSNXHSRRMX-SOUVJXGZSA-N
InChI=1S/C19H32O2/c1-6-7-18(20)21-19(4,5)15-10-8-13(2)16-11-9-14(3)17(16)12-15/h13-15H,6-12H2,1-5H3/t13-,14-,15+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
GUAIYL BUTYRATE
Common Name English
2-((3S,5R,8S)-3,8- DIMETHYL-1,2,3,4,5,6,7,8-OCTAHYDROAZULEN-5-YL) PROPAN-2-YL BUTANOATE
Systematic Name English
GUAIOL BUTYRATE
Common Name English
Code System Code Type Description
FDA UNII
BXX9GGI596
Created by admin on Fri Dec 15 16:05:00 GMT 2023 , Edited by admin on Fri Dec 15 16:05:00 GMT 2023
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CAS
73003-91-5
Created by admin on Fri Dec 15 16:05:00 GMT 2023 , Edited by admin on Fri Dec 15 16:05:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID10888356
Created by admin on Fri Dec 15 16:05:00 GMT 2023 , Edited by admin on Fri Dec 15 16:05:00 GMT 2023
PRIMARY
PUBCHEM
175381
Created by admin on Fri Dec 15 16:05:00 GMT 2023 , Edited by admin on Fri Dec 15 16:05:00 GMT 2023
PRIMARY
ECHA (EC/EINECS)
277-213-2
Created by admin on Fri Dec 15 16:05:00 GMT 2023 , Edited by admin on Fri Dec 15 16:05:00 GMT 2023
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