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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H32O6
Molecular Weight 416.5073
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHYLTETRALIN

SMILES

COC[C@H]1CC2=CC(OC)=C(OC)C=C2[C@H]([C@@H]1COC)C3=CC(OC)=C(OC)C=C3

InChI

InChIKey=CZZKSEXMNQGXJU-ROMRWMGNSA-N
InChI=1S/C24H32O6/c1-25-13-17-9-16-11-22(29-5)23(30-6)12-18(16)24(19(17)14-26-2)15-7-8-20(27-3)21(10-15)28-4/h7-8,10-12,17,19,24H,9,13-14H2,1-6H3/t17-,19-,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H32O6
Molecular Weight 416.5073
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:22:40 UTC 2023
Edited
by admin
on Sat Dec 16 14:22:40 UTC 2023
Record UNII
DN67OWS5VP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHYLTETRALIN
Common Name English
(+)-PHYLTETRALIN
Common Name English
(1R,2S,3S)-1-(3,4-DIMETHOXYPHENYL)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-2,3-BIS(METHOXYMETHYL)NAPHTHALENE
Systematic Name English
NAPHTHALENE, 1-(3,4-DIMETHOXYPHENYL)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-2,3-BIS(METHOXYMETHYL)-, (1R,2S,3S)-
Systematic Name English
NAPHTHALENE, 1-(3,4-DIMETHOXYPHENYL)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-2,3-BIS(METHOXYMETHYL)-, (1R-(1.ALPHA.,2.BETA.,3.ALPHA.))-
Systematic Name English
Code System Code Type Description
CAS
123048-17-9
Created by admin on Sat Dec 16 14:22:40 UTC 2023 , Edited by admin on Sat Dec 16 14:22:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID401317953
Created by admin on Sat Dec 16 14:22:40 UTC 2023 , Edited by admin on Sat Dec 16 14:22:40 UTC 2023
PRIMARY
PUBCHEM
11223782
Created by admin on Sat Dec 16 14:22:40 UTC 2023 , Edited by admin on Sat Dec 16 14:22:40 UTC 2023
PRIMARY
FDA UNII
DN67OWS5VP
Created by admin on Sat Dec 16 14:22:40 UTC 2023 , Edited by admin on Sat Dec 16 14:22:40 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT