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View Conjugates details

ConjuPepDB ID: cpd01005

Chemical structure


molecule
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cpd01005


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
SGC 3-Methoxyestra-1,3,5(10),16-tetraeno[17,16-d]pyrimidin-2′-amine
Identification
ConjuPepDB ID

cpd01005

Smiles
Molecular weight

838.388

Molecular formula

C49H54N6O5S

Chemical name
Peptide information
Sequence (one letter)

SGC

Length

3

Peptide name

tripeptide

External ID
CAS number

1199559-02-8

Other information
Application

Diagnostic, detection of estrogen positive breast cancer cells

Additional function

Radiolabel complexation

Pharmacological class

other

Conjugate type

amide

Linker

no

Small molecule

3-Methoxyestra-1,3,5(10),16-tetraeno[17,16-d]pyrimidin-2′-amine

Small molecule CAS

669056-32-0

Structure method

1H and 13C NMR

Calculated properties
LogP

7.36338

Rotatable bonds

17

H bond donor

4

H bond acceptor

8

Polar surface area (PSA)

157.56000

Citations
ID Title Year Authors Journal DOI

cpdart0149

Estrano[17,16-e]pyrimidine-amino acid and estrano[17,16-e]pyrimidine-peptide conjugates

2009

Matsumoto, Tomohiro; Shiine, Kodai; Mataka, Shuntaro; Thiemann, Thies

Journal of Chemical Research

..