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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H27ClO6
Molecular Weight 410.888
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of AL-12180

SMILES

O[C@@H](COC1=CC(Cl)=CC=C1)\C=C\[C@H]2OC[C@H](O)[C@@H]2CC\C=C/CCC(O)=O

InChI

InChIKey=GLYAVTUPQOQHAD-MOBTWWNESA-N
InChI=1S/C21H27ClO6/c22-15-6-5-7-17(12-15)27-13-16(23)10-11-20-18(19(24)14-28-20)8-3-1-2-4-9-21(25)26/h1-2,5-7,10-12,16,18-20,23-24H,3-4,8-9,13-14H2,(H,25,26)/b2-1-,11-10+/t16-,18+,19+,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H27ClO6
Molecular Weight 410.888
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:49:40 GMT 2023
Edited
by admin
on Fri Dec 15 15:49:40 GMT 2023
Record UNII
1GY0F1HMVT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AL-12180
Common Name English
L-ALTRO-OCT-3-ENITOL, 5,8-ANHYDRO-6-((3Z)-6-CARBOXY-3-HEXENYL)-1-O-(3-CHLOROPHENYL)-3,4,6-TRIDEOXY-, (3E)-
Common Name English
Code System Code Type Description
CAS
748816-43-5
Created by admin on Fri Dec 15 15:49:40 GMT 2023 , Edited by admin on Fri Dec 15 15:49:40 GMT 2023
PRIMARY
FDA UNII
1GY0F1HMVT
Created by admin on Fri Dec 15 15:49:40 GMT 2023 , Edited by admin on Fri Dec 15 15:49:40 GMT 2023
PRIMARY
PUBCHEM
59107184
Created by admin on Fri Dec 15 15:49:40 GMT 2023 , Edited by admin on Fri Dec 15 15:49:40 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY