Analyte Name

9-Deoxydoxorubicin Hydrochloride

CAS Number

73027-02-8

Molecular Formula

C27H29NO10.HCl

Molecular Weight

563.99

Accurate Mass

563.16

SMILES

OC1=C2C(C(C3=C(OC)C=CC=C3C2=O)=O)=C(C4=C1C[C@H](C[C@@H]4O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O)N)C(CO)=O)O.Cl

InChI

InChI=1S/C27H29NO10.ClH/c1-10-23(31)14(28)8-18(37-10)38-17-7-11(15(30)9-29)6-13-20(17)27(35)22-21(25(13)33)24(32)12-4-3-5-16(36-2)19(12)26(22)34;/h3-5,10-11,14,17-18,23,29,31,33,35H,6-9,28H2,1-2H3;1H/t10-,11+,14-,17-,18-,23+;/m0./s1

IUPAC

(8R,10S)-10-(((2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-6,11-dihydroxy-8-(2-hydroxyacetyl)-1-methoxy-7,8,9,10-tetrahydrotetracene-5,12-dione hydrochloride

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat