Dihydroxy-4,4,14-trimethyl-5α-pregn-8-en-20-one, 3β,21-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H38O3
Molecular Weight	374.5567
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Dihydroxy-4,4,14-trimethyl-5α-pregn-8-en-20-one, 3β,21-

Structure Search

SMILES

[H][C@@]12CCC3=C(CC[C@]4(C)[C@H](CC[C@@]34C)C(=O)CO)[C@@]1(C)CC[C@H](O)C2(C)C

InChI

InChIKey=KUZAKLLYYNJTRA-CEGYNPMNSA-N

InChI=1S/C24H38O3/c1-21(2)19-7-6-16-15(22(19,3)11-10-20(21)27)8-12-24(5)17(18(26)14-25)9-13-23(16,24)4/h17,19-20,25,27H,6-14H2,1-5H3/t17-,19+,20+,22-,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H38O3
Molecular Weight	374.5567
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:07:52 GMT 2023` Edited by `admin` on `Sat Dec 16 20:07:52 GMT 2023`
Record UNII	4LJQ55T2MP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Dihydroxy-4,4,14-trimethyl-5α-pregn-8-en-20-one, 3β,21-

Systematic Name

English

5α-Pregn-8-en-20-one, 3β,21-dihydroxy-4,4,14-trimethyl-

Systematic Name

English

2-hydroxy-1-[(10S,13R,14R,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

Systematic Name

English

3β,21-Dihydroxy-4,4,14-trimethyl-5α-pregn-8-en-20-one

Systematic Name

English

NSC-80996

Code

English

Code System Code Type Description

PUBCHEM

11954097

Created by admin on Sat Dec 16 20:07:52 GMT 2023 , Edited by admin on Sat Dec 16 20:07:52 GMT 2023

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CAS

6674-59-5

Created by admin on Sat Dec 16 20:07:52 GMT 2023 , Edited by admin on Sat Dec 16 20:07:52 GMT 2023

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NSC

80996

Created by admin on Sat Dec 16 20:07:52 GMT 2023 , Edited by admin on Sat Dec 16 20:07:52 GMT 2023

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FDA UNII

4LJQ55T2MP

Created by admin on Sat Dec 16 20:07:52 GMT 2023 , Edited by admin on Sat Dec 16 20:07:52 GMT 2023

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