4β,5β-epoxypregnane-3,20-dione (Q27266414)

UNII-75W388XI28 (English)

14 October 2016

chemical formula

C₂₁H₃₀O₃

1 reference

UNII-75W388XI28 (English)

14 October 2016

canonical SMILES

CC(=O)C1CCC2C1(CCC3C2CCC45C3(CCC(=O)C4O5)C)C

1 reference

UNII-75W388XI28 (English)

14 October 2016

isomeric SMILES

CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@]45[C@@]3(CCC(=O)C4O5)C)C

1 reference

UNII-75W388XI28 (English)

InChI=1S/C21H30O3/c1-12(22)14-4-5-15-13-6-11-21-18(24-21)17(23)8-10-20(21,3)16(13)7-9-19(14,15)2/h13-16,18H,4-11H2,1-3H3/t13-,14+,15-,16-,18?,19+,20+,21-/m0/s1

14 October 2016

Identifiers

InChI

1 reference

UNII-75W388XI28 (English)

AHUAGQAMTIBPDR-LBFMWMSASA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-75W388XI28 (English)

14 October 2016

1 reference

UNII

75W388XI28

4β,5β-epoxypregnane-3,20-dione (English)

14 October 2016

1 reference

(4beta,5beta)-4,5-Epoxypregnane-3,20-dione (English)

14 October 2016

2 references

UNII-75W388XI28 (English)

matched by identifier from

14 October 2016

InChIKey

AHUAGQAMTIBPDR-LBFMWMSASA-N

1 reference

0 references

1 reference

Global Substance Registration System

UNII

75W388XI28

4β,5β-epoxypregnane-3,20-dione (English)