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5,12-Dihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,6,11-tetrahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside

HCID 196554
NotesReactions

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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
80996-23-2
Standard SMILES
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C=C(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1
InChIKey
GNZRKCZTDXRJOT-DYOIPSMXSA-N
Molecular formula
C27H27NO10
Average molar mass
525.51 g/mol
Monoisotopic mass
525.16349606

Names & identifiers

Preferred name
5,12-Dihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,6,11-tetrahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside
IUPAC
(1S)-5,12-Dihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,6,11-tetrahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside
English name
9,10-anhydroadriamycin
Molecular formula
C27H27NO10
Molecular weight
525.51

Names & synonyms

Doxorubicin Impurity 89,10-anhydroadriamycinDoxorubicin Impurity N1Doxorubicin Impurity 259,10-Anhydro Doxorubicin9,10-Anhydro Doxorubicin TFA9,10-Anhydro Doxorubicin DiscontinuedEpirubicin Impurity 14(9,10-Anhydro Doxorubicin)Doxorubicin Impurity 8 (9,10-Anhydro Doxorubicin)(S)-10-[(3-AMino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-9,10-dihydro-6,11-dihydroxy-8-(hydroxyacetyl)-1-Methoxy-5,12-naphthacenedione

Database identifiers

CAS
80996-23-2
PubChem CID
196554
DTXSID
DTXSID201001687

Properties

Physicochemical properties

Boiling point
788.7 · 788.7±60.0 °C(Predicted)
Density
1.58 · 1.58±0.1 g/cm3(Predicted)
pka
6.51 · 6.51±0.40(Predicted)

Chemistry & industry

Applications

UsesDoxorubicin (D558000) analog as antitumor

Suppliers16 total

广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
深圳菲斯生物科技有限公司0755-83725681-603
湖北扬信医药科技有限公司15347293736 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
BOC Sciences16314854226 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
广州市桐晖药业有限公司020-66392521-118 18922260391 · [email protected]
常州翔龙医药科技有限公司18661161657 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]