Products for Research Use Only
RegisterLogin

Doxorubicin EP Impurity B

CAT: 1596-AR-D02374-01Size: 10 UnitsDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1596-AR-D02374-01Size:10 Units
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
106401-68-7
Synonyms
(8S,10S) -10- (((2R,4S,5S,6S) -4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl) oxy) -8- (2-bromo-1,1-dimethoxyethyl) -6,8,11-trihydroxy-1-methoxy-7,8,9,10-tetrahydrotetracene-5,12-dione; Doxorubicin Ketal Impurity; Doxorubicin Impurity B; (8S,10S) -10-[ (3-Amino-2,3,6-trideoxy-?-L-lyxo-hexopyranosyl) oxy]-8- (2-bromo-1,1-dimethoxyethyl) -7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione
Molecular Formula
C29H34BrNO11
Molecular Weight
652.5
API Name
Doxorubicin

Chemical Information

Daunorubicin bromoketal
CAS Number106401-68-7
PubChem CID72941581
IUPAC Name(7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-9-(2-bromo-1,1-dimethoxyethyl)-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
Molecular FormulaC29H34BrNO11
Molecular Weight652.5
XLogP2.6
Topological Polar Surface Area187
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count12
Rotatable Bond Count7
Heavy Atom Count42
Formal Charge0
Complexity1010
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(CBr)(OC)OC)O)N)O
InChI
InChI=1S/C29H34BrNO11/c1-12-23(32)15(31)8-18(41-12)42-17-10-28(37,29(11-30,39-3)40-4)9-14-20(17)27(36)22-21(25(14)34)24(33)13-6-5-7-16(38-2)19(13)26(22)35/h5-7,12,15,17-18,23,32,34,36-37H,8-11,31H2,1-4H3/t12-,15-,17-,18-,23+,28-/m0/s1
InChIKey
JIMPRCTWUQVCIT-BJRCHLRVSA-N
Chemical Structure
2D Structure
2D structure of Daunorubicin bromoketal
CAS: 106401-68-7
CID: 72941581
Formula: C29H34BrNO11
MW: 652.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight652.5
XLogP32.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count12
Rotatable Bond Count7
Exact Mass651.13152
Monoisotopic Mass651.13152
Topological Polar Surface Area187 Ų
Heavy Atom Count42
Formal Charge0
Complexity1010
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
AR-D02371-01Doxorubicinone (Doxorubicin EP Impurity D; Epirubicin EP Impurity A)
AR-D02376-01Doxorubicin EP Impurity C HBr
AR-D02383-01Epimer of Doxorubicin Impurity B
AR-N08134-01Naloxone EP Impurity A (Naltrexone EP Impurity B)
AR-P02106-01Povidone EP Impurity B (Piracetam EP Impurity A)
AR-T01738-01Epirubicin EP Impurity B (Daunorubicin EP Impurity A)
AR-D07726-01Doxorubicin Impurity 50
AR-D02386-01Doxorubicin Impurity 7
AR-D02394-01Doxorubicin Impurity 13
AR-D02392-01Doxorubicin Impurity 11

Alternative Products

CatalogName
AA64743-01Doxorubicin impurity
AD64740-01Doxorubicin Impurity 2
ID163220-01Doxorubicin Impurity 15
RM-D240350-01Doxorubicin Impurity 50
RM-D240411-01Doxorubicin Impurity 53
RM-D240412-01Doxorubicin Impurity 54
RM-D240334-01Doxorubicin Impurity 34
RM-D240331-01Doxorubicin Impurity 31
RM-D240345-01Doxorubicin Impurity 45
RM-D240351-01Doxorubicin Impurity 51

Popular Products