Caffeine Metabolism

Metabolites

1-Methyluric acid

Formula: C6H6N4O3 (182.0439886)

CAS ID: 708-79-2

1-Methylxanthine

Formula: C6H6N4O2 (166.0490736)

CAS ID: 6136-37-4

1,3,7-Trimethyluric acid

Formula: C8H10N4O3 (210.075287)

CAS ID: 5415-44-1

1,7-Dimethyluric acid

Formula: C7H8N4O3 (196.0596378)

CAS ID: 33868-03-0

1,7-Dimethylxanthine

Formula: C7H8N4O2 (180.0647228)

CAS ID: 611-59-6

3,7-Dimethyluric acid

Formula: C7H8N4O3 (196.0596378)

CAS ID: 13087-49-5

5-Acetylamino-6-amino-3-methyluracil

Formula: C7H10N4O3 (198.075287)

CAS ID: 19893-78-8

5-Acetylamino-6-formylamino-3-methyluracil

Formula: C8H10N4O4 (226.070202)

CAS ID: 85438-96-6

7-Methyluric acid

Formula: C6H6N4O3 (182.0439886)

CAS ID: 612-37-3

7-Methylxanthine

Formula: C6H6N4O2 (166.0490736)

CAS ID: 552-62-5

Acetyl-CoA

Formula: C23H38N7O17P3S (809.1257688000001)

CAS ID: 72-89-9

Caffeine

Formula: C8H10N4O2 (194.080372)

CAS ID: 58-08-2

Formaldehyde

Formula: CH2O (30.0105642)

CAS ID: 50-00-0

H2O

Formula: H2O (18.0105642)

CAS ID: 7732-18-5

Hydrogen peroxide

Formula: H2O2 (34.0054792)

CAS ID: 7722-84-1

NAD+

Formula: C21H28N7O14P2 (664.1169428000001)

CAS ID: 53-84-9

NADH

Formula: C21H29N7O14P2 (665.1247674)

CAS ID: 58-68-4

Oxygen

Formula: O2 (31.98983)

CAS ID: 7782-44-7

Theobromine

Formula: C7H8N4O2 (180.0647228)

CAS ID: 83-67-0

Theophylline

Formula: C7H8N4O2 (180.0647228)

CAS ID: 58-55-9



Enzyme

EC Number name full name note
1.14.13.n7
1.14.14.1 unspecific monooxygenase substrate,NADPH-hemoprotein reductase:oxygen oxidoreductase (RH-hydroxylating or -epoxidizing)


Proteins

Protein ID name full name