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Topotecan Hydrochloride

PubChem CID: 60699

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Compound Synonyms TOPOTECAN HYDROCHLORIDE, 119413-54-6, Topotecan Hcl, Hycamtin, Nogitecan hydrochloride, Topotecan (Hydrochloride), Topotecan monohydrochloride, Evotopin, Topotecan teva, Topotecan Hospira, SK&F S-104864-A, Hycamptamine hydrochloride, potactasol, Topotecan hydrochloride [USAN], NSC 609699, DRG-0288, Topotecan (as hydrochloride), NSC-759263, UNII-956S425ZCY, DTXSID1045952, Topotecan Actavis, 956S425ZCY, SK&F-S-104864-A, (S)-10-((Dimethylamino)methyl)-4-ethyl-4,9-dihydroxy-1H-pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H,12H)-dione monohydrochloride, NSC-609699, DTXCID9025952, NSC609699, NSC 759263, (S)-10-[(Dimethylamino)methyl]-4-ethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[l,2-b]quinoline-3,14(4H,12H)-dione monohydrochloride, 1H-Pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H,12H)-dione, 10-((dimethylamino)methyl)-4-ethyl-4,9-dihydroxy-, monohydrochloride, (S)-, NCGC00095189-01, Hycamtin (TN), SKF 104864A, NSC 609669, (S)-10-((dimethylamino)methyl)-4-ethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione hydrochloride, Nogitecan hydrochloride (JAN), Topotecan hydrochloride (USAN), SKF 104864A (Hydrochloride), NSC 609669 (Hydrochloride), CHEMBL1607, NOGITECAN HYDROCHLORIDE [JAN], MFCD00866235, TOPOTECAN HYDROCHLORIDE (MART.), TOPOTECAN HYDROCHLORIDE [MART.], TOPOTECAN HYDROCHLORIDE (USP-RS), TOPOTECAN HYDROCHLORIDE [USP-RS], SMR000466344, CAS-119413-54-6, SK&F-S-104864A, Evotropin, Potactasol (TN), SKF 104864A, Topotecan Hydrocholoride, Hydrochloride, Nogitecan, Hydrochloride, Topotecan, SCHEMBL7247, Hycamtin (TN) (GlaxoSmith), MLS000759456, MLS001401447, SPECTRUM1505820, topotecan hydrochloride (oral), CHEBI:232548, HMS1922H22, HY-13768AR, Pharmakon1600-01505820, BCP00930, SKF-104864A, SKF S-104864-A, SKF-S 104864-A, TOPOTECAN HYDROCHLORIDE [MI], Tox21_111478, CCG-37460, HY-13768A, NCGC00014925, NCI609699, NK-211, NSC759263, s1231, Topotecan (hydrochloride) (Standard), AKOS015900415, Tox21_111478_1, AC-1551, CS-1498, FT28329, KS-1410, NC00177, TOPOTECAN HYDROCHLORIDE [VANDF], TOPOTECAN HYDROCHLORIDE [WHO-DD], Topotecan Monohydrochloride, (S)-Isomer, NCGC00014925-06, NCGC00095189-02, NCGC00095189-03, SW197557-5, T2795, TOPOTECAN HYDROCHLORIDE [ORANGE BOOK], D02168, E-89/001, 9-Dimethylaminomethyl-10-hydroxycamptothecin, HCl salt, Q27271753, 9-[(DIMETHYLAMINO)METHYL]-10-HYDROXY-(20S)-CAMPTOTHECIN, HCL, (19S)-8-[(dimethylamino)methyl]-19-ethyl-7,19-dihydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione, hydrochloride, (4S)-10-[(DIMETHYLAMINO)METHYL]-4-ETHYL-4,9-DIHYDROXY-1H-PYRANO[3',4',6-7]INDOLIZINO[1,2-B]QUINOLINE-3,14(4H,12H)-DIONE, (4S)-10-[(Dimethylamino)methyl]-4-ethyl-4,9-dihydroxy-1H-pyrano[3',4',6-7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione hydrochlorid e, NSC-609669, SKF-104864A, (4S)-10-[(DIMETHYLAMINO)METHYL]-4-ETHYL-4,9-DIHYDROXY-1H-PYRANO[3',4':6,7]INDOLIZINO[1,2-B]QUINOLINE-3,14(4H,12H)-DIONEHYDROCHLORIDE (1:1), (S)-10-((Dimethylamino)methyl)-4-ethyl-4,9-dihydroxy-1,12-dihydro-14H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H)-dione hydrochloride, (S)-10-((dimethylamino)methyl)-4-ethyl-4,9-dihydroxy-1H-pyrano(3',4':6,7) indolizino(1,2-b) quinoline-3,14-(4H,12H)-dione Monohydrochloride, (S)-10-((dimethylamino)methyl)-4-ethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dionehydrochloride, (S)-10-[(DIMETHYLAMINO)METHYL]-4-ETHYL-4,9-DIHYDROXY-1H-PYRANO[3',4':6,7]INDOLIZINO[1,2-B]QUINOLINE-3,14(4H,12H)-DIONEMONOHYDROCHLORIDE, 1H-Pyrano[3',7]indolizino[1,2-b]quinoline- 3,14(4H,12H)-dione, 10-[(dimethylamino)methyl]-4-ethyl-4,9-dihydroxy-, monohydrochloride, (4S)-
Topological Polar Surface Area 103.0
Hydrogen Bond Donor Count 3.0
Inchi Key DGHHQBMTXTWTJV-BQAIUKQQSA-N
Rotatable Bond Count 3.0
Synonyms 9-Dimethylaminomethyl-10-hydroxycamptothecin, HCl salt, Evotropin, Hycamptamine, Hycamptamine hydrochloride, Hycamtin, Hycamtin (TN), Nogitecan hydrochloride, Nogitecan hydrochloride (jan), Topotecan, Topotecan HCL, Topotecan hydrochloride, Topotecan hydrochloride (usan), Topotecan hydrochloride [usan], Topotecan monohydrochloride, Potactasol, 9 Dimethylaminomethyl 10 hydroxycamptothecin, 9-Dimethylaminomethyl-10-hydroxycamptothecin, Hycamtamine, Hydrochloride, nogitecan, Hydrochloride, topotecan, SK And F 104864 a, SK And F-104864-a, SK And F104864a, Topotecan monohydrochloride, (S)-isomer
Heavy Atom Count 32.0
Compound Name Topotecan Hydrochloride
Kingdom Organic compounds
Description 6-oxocamphor, also known as topotecan or hycamtin, is a member of the class of compounds known as camptothecins. Camptothecins are heterocyclic compounds comprising a planar pentacyclic ring structure, that includes a pyrrolo[3,4-beta]-quinoline moiety (rings A, B and C), conjugated pyridone moiety (ring D) and one chiral center at position 20 within the alpha-hydroxy lactone ring with (S) configuration (the E-ring). 6-oxocamphor can be found in common sage, which makes 6-oxocamphor a potential biomarker for the consumption of this food product.
Exact Mass 457.14
Formal Charge 0.0
Monoisotopic Mass 457.14
Isotope Atom Count 0.0
Molecular Complexity 867.0
Hydrogen Bond Acceptor Count 7.0
Molecular Weight 457.9
Database Name fooddb_chem_all;hmdb_chem_all;pubchem
Covalent Unit Count 2.0
Defined Atom Stereocenter Count 1.0
Iupac Name (19S)-8-[(dimethylamino)methyl]-19-ethyl-7,19-dihydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione, hydrochloride
Total Atom Stereocenter Count 1.0
Molecular Framework Aromatic heteropolycyclic compounds
Total Bond Stereocenter Count 0.0
Class Camptothecins
Inchi InChI=1S/C23H23N3O5.ClH/c1-4-23(30)16-8-18-20-12(9-26(18)21(28)15(16)11-31-22(23)29)7-13-14(10-25(2)3)19(27)6-5-17(13)24-20, /h5-8,27,30H,4,9-11H2,1-3H3, 1H/t23-, /m0./s1
Smiles CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=C(C=CC(=C5CN(C)C)O)N=C4C3=C2)O.Cl
Superclass Alkaloids and derivatives
Defined Bond Stereocenter Count 0.0
Taxonomy Direct Parent Camptothecins
Molecular Formula C23H24ClN3O5

  • 1. Outgoing r'ship FOUND_IN to/from Salvia Officinalis (Plant) Rel Props:Source_db:fooddb_chem_all
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