ACETYLECHIMIDINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H33NO8
Molecular Weight	439.4993
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C\C=C(\C)C(=O)O[C@@H]1CCN2CC=C(COC(=O)[C@@](O)([C@H](C)OC(C)=O)C(C)(C)O)[C@H]12

InChI

InChIKey=LHYJPODIMQKZHJ-LETYWTNCSA-N

InChI=1S/C22H33NO8/c1-7-13(2)19(25)31-17-9-11-23-10-8-16(18(17)23)12-29-20(26)22(28,21(5,6)27)14(3)30-15(4)24/h7-8,14,17-18,27-28H,9-12H2,1-6H3/b13-7-/t14-,17+,18+,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H33NO8
Molecular Weight	439.4993
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:55:41 GMT 2025` Edited by `admin` on `Mon Mar 31 22:55:41 GMT 2025`
Record UNII	J34KR6U47C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ACETYLECHIMIDINE

Common Name

English

3'-ACETYLECHIMIDINE

Preferred Name

English

((7R,8R)-7-((Z)-2-METHYLBUT-2-ENOYL)OXY-5,6,7,8-TETRAHYDRO-3H-PYRROLIZIN-1-YL)METHYL (2R)-2-((1S)-1-ACETYLOXYETHYL)-2,3-DIHYDROXY-3-METHYLBUTANOATE

Systematic Name

English

3'-O-ACETYLECHIMIDINE

Common Name

English

L-THREO-PENTITOL, 1,5-DIDEOXY-2-C-METHYL-3-C-((((1R,7AR)-2,3,5,7A-TETRAHYDRO-1-(((2Z)-2-METHYL-1-OXO-2-BUTENYL)OXY)-1H-PYRROLIZIN-7-YL)METHOXY)CARBONYL)-, 4-ACETATE

Systematic Name

English

ECHIMIDINE MONOACETATE

Common Name

English

Code System Code Type Description

FDA UNII

J34KR6U47C

Created by admin on Mon Mar 31 22:55:41 GMT 2025 , Edited by admin on Mon Mar 31 22:55:41 GMT 2025

PRIMARY

PUBCHEM

10717911

Created by admin on Mon Mar 31 22:55:41 GMT 2025 , Edited by admin on Mon Mar 31 22:55:41 GMT 2025

PRIMARY

CAS

78184-80-2

Created by admin on Mon Mar 31 22:55:41 GMT 2025 , Edited by admin on Mon Mar 31 22:55:41 GMT 2025

PRIMARY

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