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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22O3
Molecular Weight 250.3334
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FS-1

SMILES

CC1=C[C@H](O)[C@](C)(CC1)[C@@]2(C)CC(=O)C=C2CO

InChI

InChIKey=GGGYNDMJSLHHEM-KKUMJFAQSA-N
InChI=1S/C15H22O3/c1-10-4-5-14(2,13(18)6-10)15(3)8-12(17)7-11(15)9-16/h6-7,13,16,18H,4-5,8-9H2,1-3H3/t13-,14-,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H22O3
Molecular Weight 250.3334
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:04:17 UTC 2023
Edited
by admin
on Sat Dec 16 14:04:17 UTC 2023
Record UNII
1O6GI4G6O7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FS-1
Common Name English
(4S)-4-((1R,2S)-2-HYDROXY-1,4-DIMETHYL-3-CYCLOHEXEN-1-YL)-3-(HYDROXYMETHYL)-4-METHYL-2-CYCLOPENTEN-1-ONE
Systematic Name English
FS-1 TOXIN
Common Name English
2-CYCLOPENTEN-1-ONE, 4-((1R,2S)-2-HYDROXY-1,4-DIMETHYL-3-CYCLOHEXEN-1-YL)-3-(HYDROXYMETHYL)-4-METHYL-, (4S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
21634730
Created by admin on Sat Dec 16 14:04:18 UTC 2023 , Edited by admin on Sat Dec 16 14:04:18 UTC 2023
PRIMARY
FDA UNII
1O6GI4G6O7
Created by admin on Sat Dec 16 14:04:18 UTC 2023 , Edited by admin on Sat Dec 16 14:04:18 UTC 2023
PRIMARY
CAS
104903-79-9
Created by admin on Sat Dec 16 14:04:18 UTC 2023 , Edited by admin on Sat Dec 16 14:04:18 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE TOXIC