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Details

Stereochemistry RACEMIC
Molecular Formula C17H27NO2
Molecular Weight 277.4018
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PADIMATE O

SMILES

CCCCC(CC)COC(=O)C1=CC=C(C=C1)N(C)C

InChI

InChIKey=WYWZRNAHINYAEF-UHFFFAOYSA-N
InChI=1S/C17H27NO2/c1-5-7-8-14(6-2)13-20-17(19)15-9-11-16(12-10-15)18(3)4/h9-12,14H,5-8,13H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C17H27NO2
Molecular Weight 277.4018
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Description

Padimate O is an organic compound related to the water-soluble compound PABA (4-aminobenzoic acid) that is used as an ingredient in some sunscreens. this chemical releases free radicals, damages DNA, has estrogenic activity, and causes allergic reactions in some people. Maximum FDA-approved concentration - 8%. Range of protection - UVB.

Originator

Approval Year

Conditions

ConditionModalityTargetsHighest PhaseProduct
Preventing
Unknown

Doses

AEs

OverviewOther

Other InhibitorOther SubstrateOther Inducer





Drug as perpetrator​

Tox targets

PubMed

Sample Use Guides

In Vivo Use Guide
Apply liberally 15 minutes before sun exposure. At least every 2 hours
Route of Administration: Topical
In Vitro Use Guide
Padimate-O reduces direct DNA damage in human keratinocytes from sunlight (UV-endonuclease-sensitive sites) from 4.32 to 1.52 (given as the number/megabase/kJ/m2).
Substance Class Chemical
Record UNII
Z11006CMUZ
Record Status Validated (UNII)
Record Version