UCSF

ZINC84441937

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2013 0 No

Popular Name: TETRACYCLINE HYDROCHLORIDE TETRACYCLINE HYDROCHLORIDE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1622849-58-4 , 60-54-8 , 64-75-5 , [60-54-8] , [64-75-5]

Other Names:

(-)-Tetrahcycline hydrochloride; (4S,4aS,5aS,6S,12aS)-4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide monohydrochloride; (4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-3,6,10,12,12a-pentahyd

(4S,4aS,5aS,12aS)-4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide; 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11

(4S,4aS,5aS,12aS)-4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide; Abramycin; Achromycin; Anhydrotetracycline; Deschlorobiomycin; Liquamycin; Tetracyclin; Tetracycline; Tetrazyklin

cycline

4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide

60-54-8; C06570; Tetracycline

64-75-5; Bristacycline (TN); D02122; TC; Tetracycline hydrochloride (JP16/USP)

64-75-5; Prestwick_434; Tetracycline hydrochloride

Abramycin

Abricycline

Achromycin

Achromycin hydrochloride

Achromycin V

Actisite

Agromicina

Ambramicina

Ambramycin

Amycin

Anhydrotetracycline

BAN

BAN); Tetracycline Metaphosphate (JAN)

Bio-Tetra

Biocycline

Bristaciclin

Bristaciclina

Bristacycline

Cefracycline

CHEBI:45729; CHEBI:9474; CHEBI:26894

Ciclibion

Copharlan

CPD0-1414; tetracycline

Criseociclina

Cyclopar

Cytome

Democracin

Deschlorobiomycin

Dumocyclin

Enterocycline

FDA

GSK481

Hexadecylsulfamic acid compd. with (4S-(4alpha,4aalpha,5aalpha,6beta,12aalpha))-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:1); LS-147682; N-(n-Hexadecyl)sulfamate de tetracyc

Hostacyclin

INN

JAN

JAN); Tetracycline Phosphate Complex (FDA

Lexacycline

Limecycline

Liquamycin

LS-187078

LS-190693

Medocycline

Mericycline

MFCD00066847

MFCD00078142

MFCD00151232

Micycline

N/A

Neocycline

Oletetrin

Omegamycin

Orlycycline

Panmycin

Polycycline

Polyotic

Purocyclina

Resteclin

Retet

Robitet

Roviciclina

SK-Tetracycline

Solvocin

Sumycin

TAC

TC

Tetra-CO

Tetrabon

Tetrachel

Tetracycl

Tetracycline

Tetracycline (BAN

Tetracycline (hydrochloride)

tetracycline anion

Tetracycline HCl

Tetracycline Hydrochloride (JAN

Tetracycline hydrochloride, 'can be used as secondary standard'

Tetracycline hydrochloride, 96%

Tetracycline hydrochloride, 98%

Tetracycline II

tetracycline(1-)

Tetracycline, Antibiotic for Culture Media Use Only

tetracycline; tetracyclinum

Tetracyn

Tetradecin

Tetrafil

Tetramed

Tetraverine

Tetrex

Topicycline

Tsiklomistsin

Tsiklomitsin

USP

USP)

USP); Tetracycline (FDA

USP); Tetracycline HCl (FDA

USP); Tetracycline Metaphosphate (JAN); Tetracycline Phosphate Complex (BAN

USP); Tetracycline Metaphosphate (JAN); Tetracycline Phosphate Complex (FDA

Veracin

Vetacyclinum

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Mid Mid (pH 6-8) -0.69 -0.82 -56.84 7 10 0 186 444.44 2 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.33e+00 g/l DrugBank-approved
Melting_Point 220-223? Alfa-Aesar
Melting_Point 220-223° Alfa-Aesar
Mp [°C] 223 Acros Organics
UniProt Database Links ACRZ_ECOLI; EMRK_ECOLI; EMRY_ECOLI; FBIB_STRAU; HIAT1_HUMAN; ICAR_STAEQ; LPTR_BACCE; LPTR_BACSU; LPTR_GEOSE; LPTR_STAHY; MDFA_ECOLI; MEPA_PSEPU; MEPB_PSEPU; MEPC_PSEPU; MFS10_BOVIN; MFS10_HUMAN; MFS10_MOUSE; MFS55_MYCBO; NORB_STAA8; OMPF_ECOLI; S22A7_HUMA ChEBI
Indications Antibiotic KeyOrganics Bioactives
Target Antifection Selleck Chemicals
Patent Database Links EP1113008; EP1241160; EP1426369; EP1452533; EP1505152; EP1512742; EP1512743; EP1568369; EP1588702; EP1593742; EP1602334; EP1605043; EP1611879; EP1634607; EP1634955; EP1639994; EP1642592; EP1661883; EP1666454; EP1669077; EP1671624; EP1676579; EP1679305; EP ChEBI
H phrase H319: Causes serious eye irritation Acros Organics
H phrase H319: Causes serious eye irritation; H361d: Suspected of damaging the unborn child Acros Organics
Target Others Selleck Chemicals
P phrase P281: Use personal protective equipment as required Acros Organics
P phrase P281: Use personal protective equipment as required; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and ea Acros Organics
R phrase R36: Irritating to eyes. Acros Organics
R phrase R36: Irritating to eyes.; R63: Possible risk of harm to the unborn child. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. Acros Organics
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.