Primary Record
Theprubicin
- In stock
- 6,639 g
- Purity
- 99.5 %
- CAS
- 95343-20-7
Compound Identifiers & Properties
- CAS
- 95343-20-7
- PubChem CID
- 3086415
- SMILES
- C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O[C@H]6CCCCO6.Cl
- Canonical SMILES
- COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O[C@H]2CCCCO2)[C@H](C)O1.Cl
Names & Synonyms
- Theprubicin
- Pirarubicin HCl
- Pinorubin (TN)
- Therarubicin (TN)
- Pirarubicin hydrochloride
- RefChem:1065844
- AC1MJ65D
- C32H38ClNO12
- C32H37NO12.ClH
- UNII-E7V83174BE
- DTXSID00915024
- 4'-O-Tetrahydropyranyladriamycin
- SCHEMBL29350487
- DTXCID401344007
- C32-H37-N-O12.Cl-H
- CID3086415
- X5866
- D08386
- 95343-20-7
- (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-6-methyl-5-[(2S)-oxan-2-yl]oxyoxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride
- 3,5,12-Trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-4-O-oxan-2-ylhexopyranoside--hydrogen chloride (1/1)
- (1S,3S)-3,5,12-Trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxy-4-O-[(2S)-oxan-2-yl]-alpha-L-lyxo-hexopyranoside--hydrogen chloride (1/1)
- (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-6-methyl-5-[(2S)-oxan-2-yl]oxyoxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride
- 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-10-((3-amino-2,3,6-trideoxy-4-O-(tetrahydro-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)oxy)-8-(hydroxyacetyl)-1-methoxy-6,8,11-trihydroxy-, hydrochloride, (8S-(8-alpha,10-alpha-(S*)))-