13.BETA.,17.ALPHA.-DIETHYL-3.ALPHA.,17.BETA.-DIHYDROXY-5.BETA.-GONANE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H36O2
Molecular Weight	320.5093
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 13.BETA.,17.ALPHA.-DIETHYL-3.ALPHA.,17.BETA.-DIHYDROXY-5.BETA.-GONANE

Structure Search

SMILES

[H][C@@]12CC[C@@](O)(CC)[C@@]1(CC)CC[C@@]3([H])[C@@]2([H])CC[C@]4([H])C[C@H](O)CC[C@]34[H]

InChI

InChIKey=KQIPRUISTDIUTD-UJCQGIJZSA-N

InChI=1S/C21H36O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h14-19,22-23H,3-13H2,1-2H3/t14-,15-,16+,17-,18-,19+,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H36O2
Molecular Weight	320.5093
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 11:21:56 GMT 2023` Edited by `admin` on `Sat Dec 16 11:21:56 GMT 2023`
Record UNII	KSE32NEC19
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

13.BETA.,17.ALPHA.-DIETHYL-3.ALPHA.,17.BETA.-DIHYDROXY-5.BETA.-GONANE

Common Name

English

13.BETA.,17.ALPHA.-DIETHYL-5.BETA.-GONANE-3.ALPHA.,17.BETA.-DIOL

Systematic Name

English

18,19-DINORPREGNANE-3,17-DIOL, 13-ETHYL-, (3.ALPHA.,5.BETA.,17.ALPHA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

101431515

Created by admin on Sat Dec 16 11:21:56 GMT 2023 , Edited by admin on Sat Dec 16 11:21:56 GMT 2023

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FDA UNII

KSE32NEC19

Created by admin on Sat Dec 16 11:21:56 GMT 2023 , Edited by admin on Sat Dec 16 11:21:56 GMT 2023

PRIMARY

CAS

87304-65-2

Created by admin on Sat Dec 16 11:21:56 GMT 2023 , Edited by admin on Sat Dec 16 11:21:56 GMT 2023

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