Product Code

TRC-H942120

CAS Number

178971-92-1

Product Format

Neat

Molecular Formula

C23H25N5O4

Molecular Weight

435.48

API Family

Estrone

Product Categories

TRC, Hormones, Steroids and derivatives, Hormones, Impurity Reference Materials , Additional Cancer Bioactive Molecules, Hormones, Steroids and derivatives

Product Type

Impurity, Metabolite

Drug Type

Steroids / Hormones

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

4-Hydroxy Estrone 1-N7-Guanine

CAS Number

178971-92-1

Molecular Formula

C23H25N5O4

Molecular Weight

435.48

Accurate Mass

435.1907

SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C3C(=CC(=C4O)O)N5C=NC6=C5C(=O)N=C(N6)N

InChI

InChI=1S/C23H25N5O4/c1-23-7-6-11-10(13(23)4-5-16(23)30)2-3-12-17(11)14(8-15(29)19(12)31)28-9-25-20-18(28)21(32)27-22(24)26-20/h8-11,13,29,31H,2-7H2,1H3,(H3,24,26,27,32)/t10-,11+,13+,23+/m1/s1

IUPAC

2-amino-7-[(8R,9S,13S,14S)-3,4-dihydroxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-1-yl]-3H-purin-6-one

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Estrone

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4-Hydroxy Estrone 1-N7-Guanine

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