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Details

Stereochemistry RACEMIC
Molecular Formula C33H55N7O5
Molecular Weight 629.8337
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-(1-METHYLPYRROLIDIN-2-YL)ETHYL)-6-(2-PYRROLIDIN-1YL)ETHYL-9-BENZYLOXYCARBONYL-12-DIETHYL-4,7-DIOXO-3,6,9,12-TETRAAZADODECANCARBOXAMIDE

SMILES

CCN(CC)CCN(CC(=O)N(CCN1CCCC1)CC(=O)N(CCC2CCCN2C)CC(N)=O)C(=O)OCC3=CC=CC=C3

InChI

InChIKey=BICBBLFITZWNSY-UHFFFAOYSA-N
InChI=1S/C33H55N7O5/c1-4-36(5-2)20-23-40(33(44)45-27-28-12-7-6-8-13-28)26-32(43)39(22-21-37-17-9-10-18-37)25-31(42)38(24-30(34)41)19-15-29-14-11-16-35(29)3/h6-8,12-13,29H,4-5,9-11,14-27H2,1-3H3,(H2,34,41)

HIDE SMILES / InChI

Molecular Formula C33H55N7O5
Molecular Weight 629.8337
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:26:19 GMT 2023
Edited
by admin
on Sat Dec 16 12:26:19 GMT 2023
Record UNII
Y2WEK3XK0E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-(1-METHYLPYRROLIDIN-2-YL)ETHYL)-6-(2-PYRROLIDIN-1YL)ETHYL-9-BENZYLOXYCARBONYL-12-DIETHYL-4,7-DIOXO-3,6,9,12-TETRAAZADODECANCARBOXAMIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
156360470
Created by admin on Sat Dec 16 12:26:19 GMT 2023 , Edited by admin on Sat Dec 16 12:26:19 GMT 2023
PRIMARY
SMS_ID
100000177398
Created by admin on Sat Dec 16 12:26:19 GMT 2023 , Edited by admin on Sat Dec 16 12:26:19 GMT 2023
PRIMARY
FDA UNII
Y2WEK3XK0E
Created by admin on Sat Dec 16 12:26:19 GMT 2023 , Edited by admin on Sat Dec 16 12:26:19 GMT 2023
PRIMARY