3-Oxo-5beta-steroid (Q27105483)

inferred from isomeric SMILES

1 February 2021

mass

274.22966558 dalton

1 reference

based on heuristic

chemical formula

C₁₉H₃₀O

1 reference

3-Oxo-5beta-steroid (English)

5 October 2016

canonical SMILES

CC12CCCC1C3CCC4CC(=O)CCC4(C3CC2)C

1 reference

3-Oxo-5beta-steroid (English)

5 October 2016

isomeric SMILES

CC12CCCC1C3CC[C@@H]4CC(=O)CCC4(C3CC2)C

1 reference

3-Oxo-5beta-steroid (English)

InChI=1S/C19H30O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h13,15-17H,3-12H2,1-2H3/t13-,15?,16?,17?,18?,19?/m1/s1

5 October 2016

C12C(C3C(C(CC3)*)(C)CC1)CC[C@]4(C2(CCC(C4)=O)C)[H]

1 reference

stated in

ChEBI release 2021-07-01

Identifiers

InChI

1 reference

3-Oxo-5beta-steroid (English)

VMNRNUNYBVFVQI-OCUVBNDUSA-N

5 October 2016

InChIKey

1 reference

3-Oxo-5beta-steroid (English)

5 October 2016

1 reference

(5beta,8xi,9xi,10xi,13xi,14xi)-Androstan-3-one (English)

5 October 2016

2 references

3-Oxo-5beta-steroid (English)

matched by identifier from

5 October 2016

InChIKey

VMNRNUNYBVFVQI-OCUVBNDUSA-N

1 reference

3-Oxo-5beta-steroid (English)

5 October 2016

1 reference

1 reference

3-Oxo-5beta-steroid (English)