Compound Summary

minocycline
  Compound Information
 minocycline

Compound Name:

minocycline

Compound CID:

54675783

Synonyms:

minocycline

10118-90-8

Minocyclin

Minociclina

Minocyn

More...

Iupac Name:

(4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

InChI:

InChI=1S/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,17,27-28,31,33H,7-8H2,1-4H3,(H2,24,32)/t9-,11-,17-,23-/m0/s1

InChIKey:

FFTVPQUHLQBXQZ-KVUCHLLUSA-N

Canonical Smiles:

CN(C)C1C2CC3CC4=C(C=CC(=C4C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O)N(C)C

Isomeric Smiles:

CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=CC(=C4C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O)N(C)C

Molecular Weight:

457.5

Molecular Formula:

C23H27N3O7

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 minocycline

Molecular Weight:

457.5

Molecular Formula:

C23H27N3O7

Hydrogen Bond Donor Count:

5

Hydrogen Bond Acceptor Count:

9

Rotatable Bond Count:

3

Heavy Atom Count:

33

Complexity:

971

  Synonyms
 minocycline

minocycline minocycline

minocycline

10118-90-8

Minocyclin

Minociclina

Minocyn

Dynacin

Minocin

Minomycin

CL 59806

MINO

7-Dimethylamino-6-demethyl-6-deoxytetracycline

UNII-FYY3R43WGO

CHEBI:50694

FYY3R43WGO

(4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-CARBOXAMIDE

Tri-minocycline

Minocyclinum

(4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

2-Naphthacenecarboxamide, 4,7-bis(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-, (4S,4aS,5aR,12aS)-

Minocyclinum INN-Latin

NCGC00183044-01

Borymycin

Minociclina INN-Spanish

MIY

minociclinum

Minocline

Minoz

4,7-Bis(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-2-naphthacenecarboxamide

HSDB 3130

NSC-141993

Minocin (Hydrochloride)

Vectrin (Hydrochloride)

Minocycline (USAN/INN)

BRN 3077644

Lactoferrin B & Minocycline

Lactoferrin H & Minocycline

Minocycline USAN:INN:BAN

SR-05000001675

(minocycline)

(4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2- CARBOXAMIDE

(4S,4aS,5aR,12aS)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

NSC141993

Spectrum_000967

Prestwick0_000315

Prestwick1_000315

Prestwick2_000315

Spectrum2_001047

Spectrum3_000508

Spectrum4_000062

Spectrum5_001293

SCHEMBL4042

CHEMBL1434

DSSTox_CID_25033

DSSTox_RID_80650

DSSTox_GSID_45033

SCHEMBL24315

BSPBio_002035

KBioGR_000583

KBioSS_001447

2-Naphthacenecarboxamide, 4,7-bis(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-, (4S-(4alpha,4aalpha,5aalpha,12aalpha))-

cc-666

ls-007

CHEMBL69484

DivK1c_000450

SPBio_000974

SPBio_002529

DTXSID1045033

SCHEMBL16681149

BCBcMAP01_000027

GTPL10831

KBio1_000450

KBio2_001447

KBio2_004015

KBio2_006583

KBio3_001535

NINDS_000450

HMS2090D03

KUC106429N

KSC-12-231B

ZINC4019704

Tox21_113643

BDBM50103599

LMPK07000002

ZINC14879992

AKOS015969674

ZINC100409820

BCP9000928

CL59806

DB01017

IDI1_000450

SMP1_000191

NCGC00178854-01

NCGC00178854-02

NCGC00188954-01

AC-30184

CL-59806

SBI-0051449.P003

CAS-10118-90-8

AM20090714

1371-EP2269978A2

1371-EP2269985A2

1371-EP2269991A2

1371-EP2272832A1

1371-EP2284150A2

1371-EP2284151A2

1371-EP2284152A2

1371-EP2284153A2

1371-EP2284155A2

1371-EP2284156A2

1371-EP2284164A2

1371-EP2287140A2

1371-EP2287148A2

1371-EP2287150A2

1371-EP2289871A1

1371-EP2292590A2

1371-EP2292612A2

1371-EP2295402A2

1371-EP2295419A2

1371-EP2295426A1

1371-EP2295427A1

1371-EP2298732A1

1371-EP2301534A1

1371-EP2301912A2

1371-EP2301913A1

1371-EP2301914A1

1371-EP2301916A2

1371-EP2305637A2

1371-EP2308832A1

1371-EP2308863A1

1371-EP2311451A1

1371-EP2311796A1

1371-EP2311797A1

1371-EP2311798A1

1371-EP2311799A1

1371-EP2316450A1

18M908

C07225

D05045

AB00053501-03

AB00053501_04

AB00053501_05

Q415336

J-500789

SR-05000001675-3

(2E,4S,4aR,5aS,12aR)-2-(amino-hydroxy-methylidene)-4,7-bis(dimethylamino)-10,11,12a-trihydroxy-4a,5,5a,6-tetrahydro-4H-tetracene-1,3 ,12-trione

(4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-
  Experimental Data
 minocycline

Species Dose Unit Control(Avg days) Treatment(Avg days) Avg/Med Lifespan Change(%) Control(Max days) Treatment(Max days) Max Lifespan Change(%) Significant Strain Gender PubMed Avg/Med Lifespan Change tab
Drosophila melanogaster 0.870000000000000 mM 0.000000000000000 S FEMALES 23185716 Active
Drosophila melanogaster 0.870000000000000 mM 0.000000000000000 S MALES 23185716 Active
Drosophila melanogaster 0.050000000000000 mM 49.000000000000000 80.000000000000000 0.630000000000000 S Oregon-R MALES 23947005 Active
Caenorhabditis elegans 100.000000000000000 umol/L 27.500000000000000 37.300000000000000 36.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 2.000000000000000 umol/L 27.000000000000000 25.800000000000000 -5.000000000000000 NS N2 30479271 Inactive
Caenorhabditis elegans 50.000000000000000 umol/L 21.600000000000000 31.000000000000000 43.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 200.000000000000000 umol/L 27.000000000000000 30.800000000000000 14.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 2.000000000000000 umol/L 21.700000000000000 21.900000000000000 1.000000000000000 NS N2 30479271 Inactive
Drosophila melanogaster 0.050000000000000 mM 49.000000000000000 S Oregon-R MALES 22330257 Active
Caenorhabditis elegans 200.000000000000000 umol/L 21.600000000000000 23.800000000000000 10.000000000000000 S N2 30479271 Active
Drosophila melanogaster 0.050000000000000 mM 60.600000000000000 67.870000000000000 13.600000000000000 S Canton-S FEMALES 29152127 Active
Caenorhabditis elegans 50.000000000000000 umol/L 27.500000000000000 29.000000000000000 5.000000000000000 NS N2 30479271 Inactive
Caenorhabditis elegans 100.000000000000000 umol/L 23.800000000000000 31.700000000000000 33.000000000000000 S N2 30479271 Active
Drosophila melanogaster 0.050000000000000 mM 50.290000000000000 63.710000000000000 26.700000000000000 S Canton-S MALES 29152127 Active
Caenorhabditis elegans 200.000000000000000 umol/L 27.500000000000000 39.400000000000000 43.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 100.000000000000000 umol/L 21.600000000000000 32.400000000000000 51.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 50.000000000000000 umol/L 21.700000000000000 29.000000000000000 33.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 2.000000000000000 umol/L 21.600000000000000 21.300000000000000 -2.000000000000000 NS N2 30479271 Inactive
Caenorhabditis elegans 10.000000000000000 umol/L 21.600000000000000 23.100000000000000 7.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 50.000000000000000 umol/L 23.800000000000000 25.200000000000000 6.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 10.000000000000000 umol/L 21.700000000000000 22.000000000000000 1.000000000000000 NS N2 30479271 Inactive
Caenorhabditis elegans 10.000000000000000 umol/L 27.000000000000000 26.200000000000000 -3.000000000000000 NS N2 30479271 Inactive
Caenorhabditis elegans 100.000000000000000 umol/L 27.000000000000000 35.000000000000000 30.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 2.000000000000000 umol/L 23.800000000000000 23.700000000000000 0.000000000000000 NS N2 30479271 Inactive
Drosophila melanogaster 0.360000000000000 mM 39.950000000000000 42.360000000000000 6.000000000000000 S w1118 MALES 29152127 Active
Caenorhabditis elegans 50.000000000000000 umol/L 27.000000000000000 28.600000000000000 6.000000000000000 S N2 30479271 Active
Drosophila melanogaster 0.360000000000000 mM 60.600000000000000 65.260000000000000 7.700000000000000 S Canton-S FEMALES 29152127 Active
Caenorhabditis elegans 10.000000000000000 umol/L 23.800000000000000 23.500000000000000 -1.000000000000000 NS N2 30479271 Inactive
Drosophila melanogaster 0.360000000000000 mM 37.870000000000000 43.790000000000000 15.600000000000000 S w1118 FEMALES 29152127 Active
Drosophila melanogaster 0.050000000000000 mM 39.950000000000000 46.690000000000000 16.900000000000000 S w1118 MALES 29152127 Active
Caenorhabditis elegans 10.000000000000000 umol/L 27.500000000000000 27.000000000000000 -2.000000000000000 NS N2 30479271 Inactive
Caenorhabditis elegans 2.000000000000000 umol/L 27.500000000000000 25.700000000000000 -6.000000000000000 NS N2 30479271 Inactive
Caenorhabditis elegans 200.000000000000000 umol/L 23.800000000000000 26.600000000000000 12.000000000000000 S N2 30479271 Active
Caenorhabditis elegans 100.000000000000000 umol/L 21.700000000000000 32.200000000000000 48.000000000000000 S N2 30479271 Active
Drosophila melanogaster 0.360000000000000 mM 50.290000000000000 58.180000000000000 15.700000000000000 S Canton-S MALES 29152127 Active
Caenorhabditis elegans 200.000000000000000 umol/L 21.700000000000000 28.200000000000000 30.000000000000000 S N2 30479271 Active
Drosophila melanogaster 0.050000000000000 mM 37.870000000000000 46.530000000000000 22.900000000000000 S w1118 FEMALES 29152127 Active
  Experimental Data Visualization
 minocycline

  Statistics Data
 minocycline

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans 51.000000000000000 1 25
Drosophila melanogaster 49.000000000000000 4 12
  Statistics Data Visualization
 minocycline

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