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Details

Stereochemistry RACEMIC
Molecular Formula C15H18O3
Molecular Weight 246.3016
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-hydroxy-3,5,8a-trimethyl-4H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan-4-one, (8R,8aR)-rel-

SMILES

CC1=COC2=C1C(=O)C3=C(C)CC[C@@H](O)[C@]3(C)C2

InChI

InChIKey=PFIXJSCFTAVWBW-ABAIWWIYSA-N
InChI=1S/C15H18O3/c1-8-4-5-11(16)15(3)6-10-12(9(2)7-18-10)14(17)13(8)15/h7,11,16H,4-6H2,1-3H3/t11-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H18O3
Molecular Weight 246.3016
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 Sat Dec 16 19:46:35 GMT 2023
Edited
by admin
on Sat Dec 16 19:46:35 GMT 2023
Record UNII
64ZM73NK7J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-hydroxy-3,5,8a-trimethyl-4H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan-4-one, (8R,8aR)-rel-
Systematic Name English
Naphtho[2,3-b]furan-4(9H)-one, 6,7,8,8a-tetrahydro-8-hydroxy-3,5,8a-trimethyl-, (8R,8aR)-rel-
Systematic Name English
rel-(8R,8aR)-6,7,8,8a-Tetrahydro-8-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-4(9H)-one
Systematic Name English
Code System Code Type Description
CAS
2309409-72-9
Created by admin on Sat Dec 16 19:46:35 GMT 2023 , Edited by admin on Sat Dec 16 19:46:35 GMT 2023
PRIMARY
PUBCHEM
12304272
Created by admin on Sat Dec 16 19:46:35 GMT 2023 , Edited by admin on Sat Dec 16 19:46:35 GMT 2023
PRIMARY
FDA UNII
64ZM73NK7J
Created by admin on Sat Dec 16 19:46:35 GMT 2023 , Edited by admin on Sat Dec 16 19:46:35 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE