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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H16O6
Molecular Weight 304.2946
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of WENTILACTONE A

SMILES

C[C@]12[C@@H]3[C@H](OC1=O)C=C4COC(=O)C=C4[C@@]3(C)[C@@H]5O[C@@H]5[C@@H]2O

InChI

InChIKey=UBQJSYFOVWBSFP-XUBUYMCTSA-N
InChI=1S/C16H16O6/c1-15-7-4-9(17)20-5-6(7)3-8-11(15)16(2,14(19)21-8)12(18)10-13(15)22-10/h3-4,8,10-13,18H,5H2,1-2H3/t8-,10-,11-,12+,13-,15-,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H16O6
Molecular Weight 304.2946
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:55:35 GMT 2025
Edited
by admin
on Mon Mar 31 19:55:35 GMT 2025
Record UNII
581J1Y5MJ6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
WENTILACTONE A
Common Name English
3H,8H-FURO(2',3',4':4,5)OXIRENO(7,8)NAPHTHO(2,1-C)PYRAN-3,8-DIONE, 1A,2,2A,4A,4B,6,9B,9C-OCTAHYDRO-2-HYDROXY-2A,9B-DIMETHYL-, (1AR,2R,2AR,4AR,4BR,9BS,9CS)-
Preferred Name English
Code System Code Type Description
CAS
76235-83-1
Created by admin on Mon Mar 31 19:55:35 GMT 2025 , Edited by admin on Mon Mar 31 19:55:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID70997579
Created by admin on Mon Mar 31 19:55:35 GMT 2025 , Edited by admin on Mon Mar 31 19:55:35 GMT 2025
PRIMARY
PUBCHEM
156679
Created by admin on Mon Mar 31 19:55:35 GMT 2025 , Edited by admin on Mon Mar 31 19:55:35 GMT 2025
PRIMARY
FDA UNII
581J1Y5MJ6
Created by admin on Mon Mar 31 19:55:35 GMT 2025 , Edited by admin on Mon Mar 31 19:55:35 GMT 2025
PRIMARY