Name: Name:4-HYDROXYESTRONE-1,2,16,16-D4
Brand: Angene
SKU: AG00G3HC
Rating: 90 (10 reviews)

4-HYDROXYESTRONE-1,2,16,16-D4

CAS No.:

81586-98-3

Catalog Number:

AG00G3HC

Molecular Formula:

Molecular Weight:

Catalog Number:

AG00G3HC

Chemical Name:

4-HYDROXYESTRONE-1,2,16,16-D4

CAS Number:

81586-98-3

MDL Number:

MFCD03428250

IUPAC Name:

(8R,9S,13S,14S)-1,2,16,16-tetradeuterio-3,4-dihydroxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one

InChI:

InChI=1S/C18H22O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14,19,21H,2-3,5,7-9H2,1H3/t11-,12-,14+,18+/m1/s1/i4D,6D,7D2

InChI Key:

XQZVQQZZOVBNLU-RFZGAVBWSA-N

Complexity:

448

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

290.182g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

290.395g/mol

Monoisotopic Mass:

290.182g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8