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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H14O5
Molecular Weight 250.2473
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CITRININ

SMILES

C[C@H]1OC=C2C(O)=C(C(O)=O)C(=O)C(C)=C2[C@@H]1C

InChI

InChIKey=CQIUKKVOEOPUDV-IYSWYEEDSA-N
InChI=1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,15H,1-3H3,(H,16,17)/t5-,7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H14O5
Molecular Weight 250.2473
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:40:22 UTC 2023
Edited
by admin
on Fri Dec 15 19:40:22 UTC 2023
Record UNII
3S697X6SNZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CITRININ
HSDB   MI  
Common Name English
3H-2-BENZOPYRAN-7-CARBOXYLIC ACID, 4,6-DIHYDRO-8-HYDROXY-3,4,5-TRIMETHYL-6-OXO-, (3R,4S)-
Common Name English
CITRININ [IARC]
Common Name English
NSC-186
Code English
CITRININ [MI]
Common Name English
CITRININ [HSDB]
Common Name English
Code System Code Type Description
NSC
186
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
ECHA (EC/EINECS)
208-257-2
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
MERCK INDEX
m3596
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY Merck Index
EPA CompTox
DTXSID8020333
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
FDA UNII
3S697X6SNZ
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
HSDB
3473
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
MESH
D002953
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
CAS
518-75-2
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
CHEBI
48707
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
WIKIPEDIA
CITRININ
Created by admin on Fri Dec 15 19:40:22 UTC 2023 , Edited by admin on Fri Dec 15 19:40:22 UTC 2023
PRIMARY
Related Record Type Details
TRANSPORTER -> INHIBITOR
TRANSPORTER -> INHIBITOR
TRANSPORTER -> INHIBITOR