(Q76511782)

English

5a-Dihydrotestosterone sulfate

chemical compound

In more languages

Statements

type of chemical entity

0 references

3-Oxoandrostan-17-yl hydrogen sulfate

1 reference

based on heuristic

inferred from SMILES

370.18139506 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₃₀O₅S

0 references

canonical SMILES

O=C1CCC2(C)C(C1)CCC3C4CCC(OS(=O)(=O)O)C4(C)CCC32

0 references

isomeric SMILES

C[C@]12CCC(=O)C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4OS(=O)(=O)O)C

0 references

1 reference

Simultaneous quantification of cholesterol sulfate, androgen sulfates, and progestagen sulfates in human serum by LC-MS/MS.

Identifiers

InChI=1S/C19H30O5S/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(24-25(21,22)23)19(15,2)10-8-16(14)18/h12,14-17H,3-11H2,1-2H3,(H,21,22,23)/t12-,14-,15-,16-,17-,18-,19-/m0/s1

0 references

KYVPWJSGFKNNLD-ABEVXSGRSA-N

0 references

1 reference

matched by identifier from

KYVPWJSGFKNNLD-ABEVXSGRSA-N

mapping relation type

2 references

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI=1S/C19H30O5S/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(24-25(21,22)23)19(15,2)10-8-16(14)18/h12,14-17H,3-11H2,1-2H3,(H,21,22,23)/t12-,14-,15-,16-,17-,18-,19-/m0/s1

UniChem compound ID

1 reference

DSSTox substance ID

DTXSID801335901

1 reference

matched by identifier from

KYVPWJSGFKNNLD-ABEVXSGRSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KYVPWJSGFKNNLD-ABEVXSGRSA-N

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

15 January 2022

KYVPWJSGFKNNLD-ABEVXSGRSA-N

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