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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H20O3
Molecular Weight 248.3175
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Hydroxyalantolactone, 1?-

SMILES

C[C@H]1CC[C@@H](O)[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12

InChI

InChIKey=FRNIMDDQCZHAFA-SCFTVSGOSA-N
InChI=1S/C15H20O3/c1-8-4-5-13(16)15(3)7-12-10(6-11(8)15)9(2)14(17)18-12/h6,8,10,12-13,16H,2,4-5,7H2,1,3H3/t8-,10+,12+,13+,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H20O3
Molecular Weight 248.3175
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 05:24:34 GMT 2025
Edited
by admin
on Wed Apr 02 05:24:34 GMT 2025
Record UNII
GWC62NA7PP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1beta-Hydroxyalantolactone
Preferred Name English
Hydroxyalantolactone, 1?-
Common Name English
Naphtho[2,3-b]furan-2(3H)-one, 3a,5,6,7,8,8a,9,9a-octahydro-8-hydroxy-5,8a-dimethyl-3-methylene-, (3aR,5S,8R,8aR,9aR)-
Systematic Name English
(3aR,5S,8R,8aR,9aR)-3a,5,6,7,8,8a,9,9a-Octahydro-8-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
Systematic Name English
1?-Hydroxyalantolactone
Common Name English
Naphtho[2,3-b]furan-2(3H)-one, 3a,5,6,7,8,8a,9,9a-octahydro-8-hydroxy-5,8a-dimethyl-3-methylene-, [3aR-(3a?,5?,8?,8a?,9a?)]-
Systematic Name English
(3aR,5S,8R,8aR,9aR)-8-hydroxy-5,8a-dimethyl-3-methylidene-5,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one
Systematic Name English
Code System Code Type Description
PUBCHEM
71573444
Created by admin on Wed Apr 02 05:24:34 GMT 2025 , Edited by admin on Wed Apr 02 05:24:34 GMT 2025
PRIMARY
EPA CompTox
DTXSID901313851
Created by admin on Wed Apr 02 05:24:34 GMT 2025 , Edited by admin on Wed Apr 02 05:24:34 GMT 2025
PRIMARY
FDA UNII
GWC62NA7PP
Created by admin on Wed Apr 02 05:24:34 GMT 2025 , Edited by admin on Wed Apr 02 05:24:34 GMT 2025
PRIMARY
CAS
68776-47-6
Created by admin on Wed Apr 02 05:24:34 GMT 2025 , Edited by admin on Wed Apr 02 05:24:34 GMT 2025
PRIMARY