caffeine

Test Ligands Values Explained

Test Ligand ID - A unique identifier for the test ligand
Ligand Name - Name of the test ligand

Test Ligand ID2709
Ligand Namecaffeine
PubMed Compound Id2519
StructureProduct Image
Molecular FormulaC8H10N4O2
Molecular Weight194.19
SMILESCN1C=NC2=C1C(=O)N(C(=O)N2C)C
Synonymscaffeine
58-08-2
Guaranine
1,3,7-Trimethylxanthine
Methyltheobromine
Theine
Thein
Cafeina
Koffein
Mateina
Alert-pep
Caffein
Cafipel
Coffeine
Refresh'n
Stim
Anhydrous caffeine
Cafamil
Cafecon
Caffine
Nodaca
No-Doz
Eldiatric C
Hycomine
Organex
7-Methyltheophylline
Nix Nap
Methyltheobromide
Coffeinum
Coffein
Caffeine, synthetic
3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
Tirend
1,3,7-Trimethyl-2,6-dioxopurine
1,3,7-Trimethylpurine-2,6-dione
Theophylline, 7-methyl
Tri-Aqua
Kofein
Miudol
Caffeine, anhydrous
Theobromine, 1-methyl-
1-methyltheobromine
Caffeine (natural)
Xanthine, 1,3,7-trimethyl
Propoxyphene Compound 65
Methylxanthine theophylline
caffenium
teina
Caffeina
NCI-C02733
1,3,7-Trimethyl-3,7-dihydro-1H-purine-2,6-dione
CAFFEINE ANHYDROUS
FEMA No. 2224
cafeine
Caffeinum
HSDB 36
BRN 0017705
NSC 5036
CCRIS 1314
1,3,7-trimethyl-1H-purine-2,6(3H,7H)-dione
AI3-20154
NSC-5036
EINECS 200-362-1
UNII-3G6A5W338E
Caffeine melting point standard
DTXSID0020232
CHEBI:27732
3G6A5W338E
Caffeine [USP:BAN:JAN]
DTXCID40232
ESGIC COMPONENT CAFFEINE
TRIAD COMPONENT CAFFEINE
DIMENHYDRINATE IMPURITY C
FEMCET COMPONENT CAFFEINE
TREZIX COMPONENT CAFFEINE
ANOQUAN COMPONENT CAFFEINE
NSC5036
CAFERGOT COMPONENT CAFFEINE
EC 200-362-1
EXCEDRIN COMPONENT CAFFEINE
FIORICET COMPONENT CAFFEINE
FIORINAL COMPONENT CAFFEINE
MIGERGOT COMPONENT CAFFEINE
NORGESIC COMPONENT CAFFEINE
WIGRAINE COMPONENT CAFFEINE
DHC PLUS COMPONENT CAFFEINE
INVAGESIC COMPONENT CAFFEINE
LANORINAL COMPONENT CAFFEINE
5-26-13-00558 (Beilstein Handbook Reference)
ORPHENGESIC COMPONENT CAFFEINE
SYNALGOS-DC COMPONENT CAFFEINE
1,3,7-trimethyl-2,6-dioxo-1,2,3,6-tetrahydropurine
MEDIGESIC PLUS COMPONENT CAFFEINE
SYNALGOS-DC-A COMPONENT CAFFEINE
DARVON COMPOUND COMPONENT CAFFEINE
INVAGESIC FORTE COMPONENT CAFFEINE
CAFFEINE (IARC)
CAFFEINE [IARC]
CAFFEINE (II)
CAFFEINE [II]
ORPHENGESIC FORTE COMPONENT CAFFEINE
CAFFEINE (MART.)
CAFFEINE [MART.]
CAFFEINE (USP-RS)
CAFFEINE [USP-RS]
Caffeine (USP:BAN:JAN)
3,7-Dihydro-1,3,7-trimethyl-1H-purin-2,6-dion
CAFFEINE (EP MONOGRAPH)
CAFFEINE [EP MONOGRAPH]
CAFFEINE (USP MONOGRAPH)
CAFFEINE [USP MONOGRAPH]
Propoxyphene Compound-65
Darvon compound-65
THEOPHYLLINE IMPURITY A (EP IMPURITY)
THEOPHYLLINE IMPURITY A [EP IMPURITY]
DIMENHYDRINATE IMPURITY C (EP IMPURITY)
DIMENHYDRINATE IMPURITY C [EP IMPURITY]
PENTOXIFYLLINE IMPURITY F (EP IMPURITY)
PENTOXIFYLLINE IMPURITY F [EP IMPURITY]
DiurexUltimate
DiurexUltra
Respia
Awake
NoSnooze
Allertness Aid
Uplift Chewable
Alertness Aid
Conrx Alert
Sprayable Energy
Stay Awake
Alert Aid
Methyltheophylline
NoSnoozeCircle K
careone stay awake
Caffeine 200mg
Diurex Water Pills
Topcare Stay Awake
Caffeine1508
NoDoz Alertness Aid
AwakeMaximum Strength
Sohmed Alertness Aid
357 Super Magnum
Diurex Water PillsXPL
Alertness Aid Stay Awake
Caffeine 200 mg Tablets
Jet Alert Double Strength
Stay AwakeMaximum Strength
Jet Alert Regular Strength
Caffeine Tablets, 200 mg
Caffeine tablet, film-coated
CAFFEINE COMPONENT OF ESGIC
CAFFEINE COMPONENT OF TRIAD
Topcare Stay AwakeMaximum Strength
CAFFEINE COMPONENT OF FEMCET
NoDoz Alertness AidMaximum Strength
CAFFEINE COMPONENT OF ANOQUAN
Carolina Cannabis Uplifting Chewables
Valumeds Maximum Strength Stay Awake
CAFFEINE COMPONENT OF CAFERGOT
CAFFEINE COMPONENT OF DHC PLUS
CAFFEINE COMPONENT OF EXCEDRIN
CAFFEINE COMPONENT OF FIORICET
CAFFEINE COMPONENT OF FIORINAL
CAFFEINE COMPONENT OF MIGERGOT
CAFFEINE COMPONENT OF NORGESIC
CAFFEINE COMPONENT OF WIGRAINE
CAFFEINE COMPONENT OF INVAGESIC
CAFFEINE COMPONENT OF LANORINAL
CAFFEINE COMPONENT OF ORPHENGESIC
USEPA/OPP Pesticide Code: 000660
CAFFEINE COMPONENT OF SYNALGOS-DC
CAFFEINE COMPONENT OF SYNALGOS-DC-A
CAFFEINE COMPONENT OF MEDIGESIC PLUS
CAFFEINE COMPONENT OF DARVON COMPOUND
CAFFEINE COMPONENT OF INVAGESIC FORTE
CAFFEINE COMPONENT OF ORPHENGESIC FORTE
200-362-1
alert
aspirin; caffeine; propoxyphene hydrochloride
darvon compound
propoxyphene hydrochloride w/ aspirin and caffeine
Caffedrine
Vivarin
Dexitac
Durvitan
Phensal
Quick-Pep
Synalgos
DHCplus
1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-
Kofein [Czech]
Coffein [German]
Koffein [German]
Caffeina [Italian]
Theophylline Me
Theobromine Me
1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
SK-65 Compound
Anacin
Anacin Maximum Strength
P-A-C Analgesic Tablets
A.S.A. and Codeine Compound
MFCD00005758
CHEMBL113
CFF
Caffeine-13C
Caffeine-13C3
SK 65 Compound
Caffeine [BAN:JAN]
CAS-58-08-2
Caffeine (USP)
SMR000326667
SR-01000075187
Anhydrous caffeine (TN)
Monomethyl derivative of Theophylline
Anhydrous caffeine (JP15)
metilteobromina
Kafeina
trimetilksantina
1gfz
Caffeine, BioXtra
TNP00310
Monohydrate Caffeine
Respia (TN)
1-methyl-Theobromine
7-methyl Theophylline
Cafergot (Salt/Mix)
1,7-Trimethylxanthine
Spectrum_001301
1l5q
1l7x
2a3b
3g6m
3,7-dihydro-1,3,7-trimethyl-1H-purine
CAFFEINE [FHFI]
CAFFEINE [HSDB]
CAFFEINE [FCC]
Xanthine,3,7-trimethyl
CAFFEINE [MI]
1 3 7-trimetilksantina
CAFFEINE [VANDF]
CAFFEINUM [HPUS]
1,3,7-Trimethylxantine
Spectrum2_001261
Spectrum3_000321
Spectrum4_001782
Spectrum5_000423
Lopac-C-0750
1 3 7-Trimethylxanthine
bmse000206
CAFFEINE [WHO-DD]
CAFFEINE [WHO-IP]
MolMap_000054
Probes1_000150
Probes2_000128
C 0750
SCHEMBL5671
Anhydrous caffeine (JP18)
NCIOpen2_008255
BIDD:PXR0172
Lopac0_000228
BSPBio_001921
GTPL407
KBioGR_002325
KBioSS_001781
1,3,7-trimethyl-1,3,7-trihydropurine-2,6-dione
MLS001055341
MLS001056714
MLS001066409
BIDD:ER0554
BIDD:GT0632
Caffeine, 1mg/ml in methanol
DivK1c_000730
SPECTRUM1500155
CU-01000012617-3
SPBio_001222
CAFFEINE [ORANGE BOOK]
829 - Tea quality parameters
MEGxp0_001350
ANHYDROUS CAFFEINE [JAN]
component of Dilone (Salt/Mix)
1,7-Trimethyl-2,6-dioxopurine
ACon1_000085
BDBM10849
HMS502E12
KBio1_000730
KBio2_001781
KBio2_004349
KBio2_006917
KBio3_001141
Caffeine 1.0 mg/ml in Methanol
CAFFEINE(3-METHYL-13C)
COFFEINUM [WHO-IP LATIN]
Caffeine, powder, ReagentPlus(R)
component of Percodan (Salt/Mix)
NINDS_000730
Bio1_000473
Bio1_000962
Bio1_001451
HMS1920I09
HMS2091O11
HMS2232M13
HMS3260N17
HMS3372J18
HMS3435F10
HMS3715D13
Pharmakon1600-01500155
NoDoz Caplets and Chewable Tablets
Caffeine 10 microg/mL in Methanol
CAFFEINE ANHYDROUS [WHO-IP]
CIA28298
CS-M0795
DDA07266
XCA23885
Tox21_201685
Tox21_300010
Tox21_500228
caffeine (1,3,7-trimethylxanthine)
Caffeine 100 microg/mL in Methanol
CCG-38825
HB2846
NSC755917
PDSP1_001016
PDSP1_001235
PDSP2_001000
PDSP2_001219
STK177283
Propoxyphene Compound 65 (Salt/Mix)
AKOS000121334
5-26-13-00558 (Beilstein)
Bayer Select Headache Pain (Salt/Mix)
Caffeine, anhydrous, 99%, FCC, FG
DB00201
FT05891
LP00228
NSC-755917
SDCCGMLS-0064595.P001
SDCCGMLS-0064595.P002
SDCCGSBI-0050216.P005
IDI1_000730
3,3,7-trimethyl-1H-purine-2,6-dione
NCGC00015208-01
NCGC00015208-02
NCGC00015208-03
NCGC00015208-04
NCGC00015208-05
NCGC00015208-06
NCGC00015208-07
NCGC00015208-08
NCGC00015208-10
NCGC00015208-11
NCGC00015208-12
NCGC00015208-13
NCGC00015208-14
NCGC00015208-15
NCGC00015208-16
NCGC00015208-17
NCGC00015208-18
NCGC00015208-20
NCGC00015208-27
NCGC00015208-29
NCGC00090699-01
NCGC00090699-02
NCGC00090699-03
NCGC00090699-04
NCGC00090699-05
NCGC00090699-06
NCGC00090699-07
NCGC00090699-08
NCGC00090699-09
NCGC00168808-01
NCGC00168808-02
NCGC00254057-01
NCGC00259234-01
NCGC00260913-01
95789-13-2
AC-12774
AS-15340
Caffeine, SAJ special grade, >=98.5%
component of P-A-C Compound (Salt/Mix)
component of A.S.A. Compound (Salt/Mix)
SBI-0050216.P004
DB-023002
WLN: T56 BN DN FNVNVJ B1 F1 H1
C2042
EU-0100228
NS00000273
526 - Nutritional Analysis of Energy Drinks
EN300-21663
BIM-0050216.0001
C07481
D00528
Q60235
1,3,7-trimethyl-3,7-dihydropurine-2,6-dione
1H-Purine-2, 3,7-dihydro-1,3,7-trimethyl-
AB00051930-09
AB00051930_10
Caffeine, purum, anhydrous, >=99.0% (HPLC)
3,7-dihydro-1,3,7-trimethyl-1H-purine (9CI)
Caffeine, anhydrous, tested according to Ph.Eur.
L000155
Caffeine, Sigma Reference Standard, vial of 250 mg
SR-01000075187-1
SR-01000075187-4
SR-01000075187-7
SR-01000075187-8
BRD-K02404261-001-02-7
BRD-K02404261-001-03-5
BRD-K02404261-001-07-6
BRD-K02404261-001-16-7
Caffeine, certified reference material, TraceCERT(R)
Caffeine, meets USP testing specifications, anhydrous
Melting point standard 235-237C, analytical standard
1,3,7-Trimethyl-3,7-dihydro-1H-purine-2,6-dione #
Caffeine, British Pharmacopoeia (BP) Reference Standard
Caffeine, European Pharmacopoeia (EP) Reference Standard
F3371-0262
THEOPHYLLINE MONOHYDRATE IMPURITY A [EP IMPURITY]
Z104507896
07E4FB58-FD79-4175-8E3D-05BF96954522
3,7-Dihydro-1,3,7-trimethyl-1H-purin-2,6-dion (coffein)
Caffeine, United States Pharmacopeia (USP) Reference Standard
Caffeine, Pharmaceutical Secondary Standard; Certified Reference Material
Caffeine anhydrous;3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione;7-Methyltheophylline
Caffeine for system suitability, European Pharmacopoeia (EP) Reference Standard
Caffeine melting point standard, United States Pharmacopeia (USP) Reference Standard
InChI=1/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H
114303-55-8
Caffeine Melting Point Standard, Pharmaceutical Secondary Standard; Certified Reference Material
Mettler-Toledo Calibration substance ME 18872, Caffeine, analytical standard, for the calibration of the thermosystem 900, traceable to primary standards (LGC)
Created AtJan 13, 2025 2:47 pm
Updated AtJan 13, 2025 2:47 pm