Products for Research Use Only
RegisterLogin

Doxorubicin Impurity 27

CAT: 1299-RM-D240327-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1299-RM-D240327-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
121720-17-0
Synonyms
2- ((2S,4S) -4- (((2R,4S,5S,6S) -4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl) oxy) -2,5,12-trihydroxy-7-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-2-yl) -2-oxoethyl formate
Molecular Formula
C28H29NO12
Molecular Weight
571.54
Target Alternative Name
Doxorubicin
Product Name Synonym
2- ((2S,4S) -4- (((2R,4S,5S,6S) -4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl) oxy) -2,5,12-trihydroxy-7-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-2-yl) -2-oxoethyl formate

Chemical Information

2-((2S,4S)-4-(((2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-2-yl)-2-oxoethyl formate
CAS Number121720-17-0
PubChem CID177829643
IUPAC Name[2-[(2S,4S)-4-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] formate
Molecular FormulaC28H29NO12
Molecular Weight571.5
XLogP1.3
Topological Polar Surface Area212
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count13
Rotatable Bond Count7
Heavy Atom Count41
Formal Charge0
Complexity1040
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)COC=O)O)N)O
InChI
InChI=1S/C28H29NO12/c1-11-23(32)14(29)6-18(40-11)41-16-8-28(37,17(31)9-39-10-30)7-13-20(16)27(36)22-21(25(13)34)24(33)12-4-3-5-15(38-2)19(12)26(22)35/h3-5,10-11,14,16,18,23,32,34,36-37H,6-9,29H2,1-2H3/t11-,14-,16-,18-,23+,28-/m0/s1
InChIKey
FCIREWUHOASMFQ-NXTQXODASA-N
Chemical Structure
2D Structure
2D structure of 2-((2S,4S)-4-(((2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-2-yl)-2-oxoethyl formate
CAS: 121720-17-0
CID: 177829643
Formula: C28H29NO12
MW: 571.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight571.5
XLogP31.3
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count13
Rotatable Bond Count7
Exact Mass571.16897536
Monoisotopic Mass571.16897536
Topological Polar Surface Area212 Ų
Heavy Atom Count41
Formal Charge0
Complexity1040
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
RM-D240350-01Doxorubicin Impurity 50
RM-D240411-01Doxorubicin Impurity 53
RM-D240412-01Doxorubicin Impurity 54
RM-D240334-01Doxorubicin Impurity 34
RM-D240351-01Doxorubicin Impurity 51
RM-D240333-01Doxorubicin Impurity 33
RM-D240336-01Doxorubicin Impurity 36
RM-D240322-01Doxorubicin Impurity 22
RM-D240410-01Doxorubicin Impurity 52
RM-D240345-01Doxorubicin Impurity 45

Alternative Products

CatalogName
AA64743-01Doxorubicin impurity
ID163220-01Doxorubicin Impurity 15
AD64740-01Doxorubicin Impurity 2
AR-D07726-01Doxorubicin Impurity 50
AR-D02386-01Doxorubicin Impurity 7
AR-D02394-01Doxorubicin Impurity 13
AR-D02392-01Doxorubicin Impurity 11
AR-D07717-01Doxorubicin Impurity 41
AR-D07703-01Doxorubicin Impurity 25
AR-D07702-01Doxorubicin Impurity 24

Popular Products