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Doxorubicinol-[13C,d3]

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General Information
Catalog: BLP-005233
Molecular Formula: C26[13C]H28D3NO11
Molecular Weight: 549.55

Chemical Structure

Description	Doxorubicinol-[13C,d3], is the labelled analogue of Doxorubicinol, which is a metabolite of doxorubicin.
Synonyms	Doxorubicinol 13CD3
IUPAC Name	(7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-9-[(1S)-1,2-dihydroxyethyl]-6,9,11-trihydroxy-4-(trideuterio(1-13C)methoxy)-8,10-dihydro-7H-tetracene-5,12-dione
Related CAS	54193-28-1 (unlabelled)
Canonical SMILES	CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(CO)O)O)N)O
InChI	InChI=1S/C27H31NO11/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15-17,22,29-31,33,35-36H,6-9,28H2,1-2H3/t10-,13-,15-,16-,17-,22+,27-/m0/s1/i2+1D3
InChI Key	NKZRZOVSJNSBFR-OGLYUWCMSA-N
Storage	Store at -20°C