ANDROSTA-1,4,16-TRIEN-3-ONE, 9-FLUORO-6,11-DIHYDROXY-17-(METHYLSULFINYL)-, (6.BETA.,11.BETA.,17(R))-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H25FO4S
Molecular Weight	380.474
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ANDROSTA-1,4,16-TRIEN-3-ONE, 9-FLUORO-6,11-DIHYDROXY-17-(METHYLSULFINYL)-, (6.BETA.,11.BETA.,17(R))-

Structure Search

SMILES

[H][C@@]12CC=C([S@@+](C)[O-])[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]2([H])C[C@@H](O)C4=CC(=O)C=C[C@]34C

InChI

InChIKey=NTQRTWCTJVULPA-DJLRBMARSA-N

InChI=1S/C20H25FO4S/c1-18-10-16(24)20(21)13(12(18)4-5-17(18)26(3)25)9-15(23)14-8-11(22)6-7-19(14,20)2/h5-8,12-13,15-16,23-24H,4,9-10H2,1-3H3/t12-,13-,15+,16-,18-,19-,20-,26?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H25FO4S
Molecular Weight	380.474
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:16:20 GMT 2023` Edited by `admin` on `Sat Dec 16 16:16:20 GMT 2023`
Record UNII	T6DT68C3WU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ANDROSTA-1,4,16-TRIEN-3-ONE, 9-FLUORO-6,11-DIHYDROXY-17-(METHYLSULFINYL)-, (6.BETA.,11.BETA.,17(R))-

Systematic Name

English

Code System Code Type Description

PUBCHEM

3081687

Created by admin on Sat Dec 16 16:16:20 GMT 2023 , Edited by admin on Sat Dec 16 16:16:20 GMT 2023

PRIMARY

FDA UNII

T6DT68C3WU

Created by admin on Sat Dec 16 16:16:20 GMT 2023 , Edited by admin on Sat Dec 16 16:16:20 GMT 2023

PRIMARY

CAS

119262-78-1

Created by admin on Sat Dec 16 16:16:20 GMT 2023 , Edited by admin on Sat Dec 16 16:16:20 GMT 2023

PRIMARY

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