F-1394

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C33H61N3O6
Molecular Weight	595.8539
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCCCCN(CC(C)(C)C)C(=O)N[C@H]1CCCC[C@@H]1OC(=O)CCNC(=O)[C@@H]2OC(C)(C)OCC2(C)C

InChI

InChIKey=NWLFOBZKYXKBOF-NSVAZKTRSA-N

InChI=1S/C33H61N3O6/c1-9-10-11-12-13-14-17-22-36(23-31(2,3)4)30(39)35-25-18-15-16-19-26(25)41-27(37)20-21-34-29(38)28-32(5,6)24-40-33(7,8)42-28/h25-26,28H,9-24H2,1-8H3,(H,34,38)(H,35,39)/t25-,26-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C33H61N3O6
Molecular Weight	595.8539
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:09:36 GMT 2025` Edited by `admin` on `Mon Mar 31 23:09:36 GMT 2025`
Record UNII	D2PP33VT2P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

F-1394

Code

English

F1394

Preferred Name

English

N-(((4R)-2,2,5,5-TETRAMETHYL-1,3-DIOXAN-4-YL)CARBONYL)-.BETA.-ALANINE (1S,2S)-2-((((2,2-DIMETHYLPROPYL)NONYLAMINO)CARBONYL)AMINO)CYCLOHEXYL ESTER

Systematic Name

English

.BETA.-ALANINE, N-(((4R)-2,2,5,5-TETRAMETHYL-1,3-DIOXAN-4-YL)CARBONYL)-, (1S,2S)-2-((((2,2-DIMETHYLPROPYL)NONYLAMINO)CARBONYL)AMINO)CYCLOHEXYL ESTER

Systematic Name

English

(1S,2S)-2-(((2,2-DIMETHYLPROPYL)(NONYL)CARBAMOYL)AMINO)CYCLOHEXYL 3-(((4R)-2,2,5,5-TETRAMETHYL-1,3-DIOXAN-4-YL)FORMAMIDO)PROPANOATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

178067

Created by admin on Mon Mar 31 23:09:36 GMT 2025 , Edited by admin on Mon Mar 31 23:09:36 GMT 2025

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CAS

162490-89-3

Created by admin on Mon Mar 31 23:09:36 GMT 2025 , Edited by admin on Mon Mar 31 23:09:36 GMT 2025

PRIMARY

FDA UNII

D2PP33VT2P

Created by admin on Mon Mar 31 23:09:36 GMT 2025 , Edited by admin on Mon Mar 31 23:09:36 GMT 2025

PRIMARY

EPA CompTox

DTXSID30167377

Created by admin on Mon Mar 31 23:09:36 GMT 2025 , Edited by admin on Mon Mar 31 23:09:36 GMT 2025

PRIMARY

Related Record Type Details


					D2PP33VT2P

F-1394

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