OXPRENOATE POTASSIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H37O4.K
Molecular Weight	440.6572
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[K+].[H][C@@]12CC[C@@](O)(CCC([O-])=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])[C@H](CCC)CC4=CC(=O)CC[C@]34C

InChI

InChIKey=HXJITUGMCJCKCE-UYOQDFFISA-M

InChI=1S/C25H38O4.K/c1-4-5-16-14-17-15-18(26)6-10-23(17,2)19-7-11-24(3)20(22(16)19)8-12-25(24,29)13-9-21(27)28;/h15-16,19-20,22,29H,4-14H2,1-3H3,(H,27,28);/q;+1/p-1/t16-,19+,20+,22-,23+,24+,25-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	K
Molecular Weight	39.0983
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C25H37O4
Molecular Weight	401.5589
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:37:42 UTC 2023` Edited by `admin` on `Fri Dec 15 16:37:42 UTC 2023`
Record UNII	167NDD8MTE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OXPRENOATE POTASSIUM

Official Name

English

oxprenoate potassium [INN]

Common Name

English

POTASSIUM 17-HYDROXY-3-OXO-7.ALPHA.-PROPYL-17.ALPHA.-PREGN-4-ENE-21-CARBOXYLATE

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C270