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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H30N2O3
Molecular Weight 370.4852
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MMB-CHMICA

SMILES

COC(=O)[C@@H](NC(=O)C1=CN(CC2CCCCC2)C3=C1C=CC=C3)C(C)C

InChI

InChIKey=ROWZIXRLVUOMCJ-FQEVSTJZSA-N
InChI=1S/C22H30N2O3/c1-15(2)20(22(26)27-3)23-21(25)18-14-24(13-16-9-5-4-6-10-16)19-12-8-7-11-17(18)19/h7-8,11-12,14-16,20H,4-6,9-10,13H2,1-3H3,(H,23,25)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H30N2O3
Molecular Weight 370.4852
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:35:45 UTC 2023
Edited
by admin
on Sat Dec 16 17:35:45 UTC 2023
Record UNII
HEN6ZCR7GD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MMB-CHMICA
Common Name English
METHYL 2-(1-(CYCLOHEXYLMETHYL)-1H-INDOLE-3-CARBOXAMIDO)-3-METHYLBUTANOATE, (S)-
Systematic Name English
L-VALINE, N-((1-(CYCLOHEXYLMETHYL)-1H-INDOL-3-YL)CARBONYL)-, METHYL ESTER
Systematic Name English
N-((1-(CYCLOHEXYLMETHYL)-1H-INDOL-3-YL)CARBONYL)-L-VALINE METHYL ESTER
Systematic Name English
Classification Tree Code System Code
DEA NO. 7044
Created by admin on Sat Dec 16 17:35:45 UTC 2023 , Edited by admin on Sat Dec 16 17:35:45 UTC 2023
Code System Code Type Description
WIKIPEDIA
MMB-CHMICA
Created by admin on Sat Dec 16 17:35:45 UTC 2023 , Edited by admin on Sat Dec 16 17:35:45 UTC 2023
PRIMARY
PUBCHEM
125181392
Created by admin on Sat Dec 16 17:35:45 UTC 2023 , Edited by admin on Sat Dec 16 17:35:45 UTC 2023
PRIMARY
FDA UNII
HEN6ZCR7GD
Created by admin on Sat Dec 16 17:35:45 UTC 2023 , Edited by admin on Sat Dec 16 17:35:45 UTC 2023
PRIMARY
CAS
1971007-94-9
Created by admin on Sat Dec 16 17:35:45 UTC 2023 , Edited by admin on Sat Dec 16 17:35:45 UTC 2023
PRIMARY
EPA CompTox
DTXSID301009991
Created by admin on Sat Dec 16 17:35:45 UTC 2023 , Edited by admin on Sat Dec 16 17:35:45 UTC 2023
PRIMARY