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Details

Stereochemistry ACHIRAL
Molecular Formula C16H29NO
Molecular Weight 251.4076
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of DODECATETRAENOIC ACID ISOBUTYLAMIDE, (2E,4E)-

SMILES

CCCCCCC\C=C\C=C\C(=O)NCC(C)C

InChI

InChIKey=BBRMJCAPNGJKEM-AQASXUMVSA-N
InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+

HIDE SMILES / InChI

Molecular Formula C16H29NO
Molecular Weight 251.4076
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:01:35 GMT 2023
Edited
by admin
on Sat Dec 16 08:01:35 GMT 2023
Record UNII
5F4WO3BVS9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DODECATETRAENOIC ACID ISOBUTYLAMIDE, (2E,4E)-
Common Name English
2E,4E-DODECATETRAENOIC ACID ISOBUTYLAMIDE (ANG, PUR) (CONSTITUENT OF ECHINACEA ANGUSTIFOLIA ROOT, ECHINACEA PALLIDA ROOT, ECHINACEA PURPUREA ROOT AND ECHINACEA PURPUREA AERIAL PARTS) [DSC]
Common Name English
N-ISOBUTYL-(2E,4E)-DODECADIENAMIDE
Systematic Name English
2,4-DODECADIENAMIDE, N-(2-METHYLPROPYL)-, (2E,4E)-
Systematic Name English
N-ISOBUTYL-(2E,4E)-DODECA-2,4-DIENAMIDE
Systematic Name English
N-ISOBUTYLDODECA-TRANS-2,4-DIENAMIDE
Common Name English
Code System Code Type Description
FDA UNII
5F4WO3BVS9
Created by admin on Sat Dec 16 08:01:35 GMT 2023 , Edited by admin on Sat Dec 16 08:01:35 GMT 2023
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CAS
24738-51-0
Created by admin on Sat Dec 16 08:01:35 GMT 2023 , Edited by admin on Sat Dec 16 08:01:35 GMT 2023
PRIMARY
PUBCHEM
6443006
Created by admin on Sat Dec 16 08:01:35 GMT 2023 , Edited by admin on Sat Dec 16 08:01:35 GMT 2023
PRIMARY