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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H32O4
Molecular Weight 360.4871
Optical Activity ( + )
Defined Stereocenters 4 / 4
E/Z Centers 4
Charge 0

SHOW SMILES / InChI
Structure of FT-0554A

SMILES

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

InChI

InChIKey=WCQMJODEMARIPM-RVMDNROXSA-N
InChI=1S/C22H32O4/c1-6-16(2)11-9-12-18(4)14-17(3)10-7-8-13-20(24)22(5)15-19(23)21(25)26-22/h7-13,15-17,20,23-24H,6,14H2,1-5H3/b10-7+,11-9+,13-8+,18-12+/t16-,17-,20+,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H32O4
Molecular Weight 360.4871
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 4
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:58:42 UTC 2023
Edited
by admin
on Sat Dec 16 10:58:42 UTC 2023
Record UNII
J76R576X35
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FT-0554A
Code English
2(5H)-FURANONE, 3-HYDROXY-5-((1R,2E,4E,6R,8E,10E,12S)-1-HYDROXY-6,8,12-TRIMETHYL-2,4,8,10-TETRADECATETRAENYL)-5-METHYL-, (5R)-
Systematic Name English
(5R)-3-Hydroxy-5-[(1R,2E,4E,6R,8E,10E,12S)-1-hydroxy-6,8,12-trimethyl-2,4,8,10-tetradecatetraen-1-yl]-5-methyl-2(5H)-furanone
Systematic Name English
2(5H)-FURANONE, 3-HYDROXY-5-((1R,2E,4E,6R,8E,10E,12S)-1-HYDROXY-6,8,12-TRIMETHYL-2,4,8,10-TETRADECATETRAEN-1-YL)-5-METHYL-, (5R)-
Systematic Name English
(+)-FT-0554A
Common Name English
FT0554A
Code English
Code System Code Type Description
FDA UNII
J76R576X35
Created by admin on Sat Dec 16 10:58:42 UTC 2023 , Edited by admin on Sat Dec 16 10:58:42 UTC 2023
PRIMARY
CAS
402490-28-2
Created by admin on Sat Dec 16 10:58:42 UTC 2023 , Edited by admin on Sat Dec 16 10:58:42 UTC 2023
PRIMARY
PUBCHEM
25022801
Created by admin on Sat Dec 16 10:58:42 UTC 2023 , Edited by admin on Sat Dec 16 10:58:42 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY