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Details

Stereochemistry UNKNOWN
Molecular Formula C46H56N4O5
Molecular Weight 744.9606
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZYLCARBAMOYL NAPHTHYLMETHYL LAUROYLBENZOATEMETHYL DIOXOMETHYLPYRAZINOPYRIMIDINE

SMILES

CCCCCCCCCCCC(=O)OC1=CC=C(C[C@@H]2N3C([C@@H](C)N(CC4=C5C=CC=CC5=CC=C4)C2=O)N(CCC3=O)C(=O)NCC6=CC=CC=C6)C=C1

InChI

InChIKey=WUXZJFDQDIJBKF-GBWQGBPGSA-N
InChI=1S/C46H56N4O5/c1-3-4-5-6-7-8-9-10-14-24-43(52)55-39-27-25-35(26-28-39)31-41-45(53)49(33-38-22-17-21-37-20-15-16-23-40(37)38)34(2)44-48(30-29-42(51)50(41)44)46(54)47-32-36-18-12-11-13-19-36/h11-13,15-23,25-28,34,41,44H,3-10,14,24,29-33H2,1-2H3,(H,47,54)/t34-,41+,44?/m1/s1

HIDE SMILES / InChI

Molecular Formula C46H56N4O5
Molecular Weight 744.9606
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:18:09 GMT 2023
Edited
by admin
on Sat Dec 16 20:18:09 GMT 2023
Record UNII
A072BZ4KM3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZYLCARBAMOYL NAPHTHYLMETHYL LAUROYLBENZOATEMETHYL DIOXOMETHYLPYRAZINOPYRIMIDINE
INCI  
INCI  
Official Name English
ASYMMTATE
Brand Name English
BENZYLCARBAMOYL NAPHTHYLMETHYL LAUROYLBENZOATEMETHYL DIOXOMETHYLPYRAZINOPYRIMIDINE [INCI]
Common Name English
DODECANOIC ACID, 4-(((6S,9R)-OCTAHYDRO-9-METHYL-8-(1-NAPHTHALENYLMETHYL)-4,7-DIOXO-1-(((PHENYLMETHYL)AMINO)CARBONYL)-2H-PYRAZINO(1,2-A)PYRIMIDIN-6-YL)METHYL)PHENYL ESTER
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID30159272
Created by admin on Sat Dec 16 20:18:10 GMT 2023 , Edited by admin on Sat Dec 16 20:18:10 GMT 2023
PRIMARY
PUBCHEM
71587987
Created by admin on Sat Dec 16 20:18:10 GMT 2023 , Edited by admin on Sat Dec 16 20:18:10 GMT 2023
PRIMARY
CAS
1351668-35-3
Created by admin on Sat Dec 16 20:18:09 GMT 2023 , Edited by admin on Sat Dec 16 20:18:09 GMT 2023
PRIMARY
FDA UNII
A072BZ4KM3
Created by admin on Sat Dec 16 20:18:10 GMT 2023 , Edited by admin on Sat Dec 16 20:18:10 GMT 2023
PRIMARY