allopregnane-3α,20α-diol (Q27155400)

inferred from SMILES

chemical structure

Allopregnanediol.svg
1,220 × 950; 24 KB

0 references

mass

320.27153±0 dalton

1 reference

(3beta,5beta)-Pregnane-3,20-diol

566-58-5 (English)

9 October 2016

2 references

inferred from InChI

allopregnane-3β,20β-diol

2 references

inferred from InChI

allopregnane-3β,20α-diol

2 references

inferred from InChI

allopregnane-3α,20β-diol

1 reference

1 reference

1 reference

C₂₁H₃₆O₂

1 reference

566-58-5 (English)

20 November 2016

CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)O

1 reference

566-58-5 (English)

20 November 2016

C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C)O

1 reference

566-58-5 (English)

InChI=1S/C21H36O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19,22-23H,4-12H2,1-3H3/t13-,14-,15+,16-,17+,18-,19-,20-,21+/m0/s1

20 November 2016

Identifiers

InChI

1 reference

566-58-5 (English)

20 November 2016

2 references

Global Substance Registration System

566-58-5 (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

566-58-5

2 references

stated in

UNII

97N2Q625GO

allopregnane-3α,20α-diol (English)

20 November 2016

https://commonchemistry.cas.org/detail?cas_rn=566-58-5

9 April 2021

1 reference

Allopregnane-3.alpha.,20.alpha.-diol (English)

20 November 2016

2 references

566-58-5 (English)

20 November 2016

ChEBI ID

81470

mapping relation type

2 references

CHEMBL1790205 (English)

20 November 2016

International Chemical Identifier

InChI

InChI=1S/C21H36O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19,22-23H,4-12H2,1-3H3/t13-,14-,15+,16-,17+,18-,19-,20-,21+/m0/s1

1 reference

CHEMBL1790205 (English)

20 November 2016

2 references

1 reference

1 reference

Human Metabolome Database ID

HMDB0060409

2 references

Global Substance Registration System

UNII

97N2Q625GO

2 references

stated in

UNII

97N2Q625GO

allopregnane-3α,20α-diol (English)

20 November 2016

1 reference

5alpha-Pregnane-3alpha,20alpha-diol (English)