5beta-19-noretiocholanolone (Q27285374)

inferred from SMILES

chemical structure

19-Noretiocholanolone.svg
1,125 × 845; 21 KB

0 references

mass

276.209 dalton

1 reference

19-Noretiocholanolone (English)

14 October 2016

stereoisomer of

19-norepiandrosterone

2 references

inferred from InChIKey

5alpha-19-norandrosterone

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₁₈H₂₈O₂

1 reference

19-Noretiocholanolone (English)

14 October 2016

canonical SMILES

CC12CCC3C4CCC(CC4CCC3C1CCC2=O)O

1 reference

19-Noretiocholanolone (English)

14 October 2016

isomeric SMILES

C[C@]12CC[C@@H]3[C@H]4CC[C@H](C[C@H]4CC[C@H]3[C@@H]1CCC2=O)O

1 reference

19-Noretiocholanolone (English)

InChI=1S/C18H28O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h11-16,19H,2-10H2,1H3/t11-,12-,13+,14-,15-,16+,18+/m1/s1

14 October 2016

Identifiers

InChI

1 reference

19-Noretiocholanolone (English)

14 October 2016

1 reference

Global Substance Registration System

19-Noretiocholanolone (English)

14 October 2016

2 references

UNII

O5Z6602I6U

19-noretiocholanolone (English)

14 October 2016

https://commonchemistry.cas.org/detail?cas_rn=33036-33-8

9 April 2021

1 reference

(3alpha,5beta)-3-Hydroxyestran-17-one (English)

14 October 2016

2 references

19-Noretiocholanolone (English)

14 October 2016

SureChEMBL ID

SCHEMBL1802861

2 references

inferred from InChIKey

1 reference

1 reference

Human Metabolome Database ID

HMDB0005886

2 references

inferred from InChIKey

Global Substance Registration System

UNII

O5Z6602I6U

2 references

stated in

UNII

O5Z6602I6U

19-noretiocholanolone (English)

14 October 2016