Compound - Results

Secretin

Java required.


Information Structure
Name Secretin
Synonyms
EINECS 215-733-3
Secrepan
Secretin
Secretin-Kabi
Secretina
Secretine
Secretinum
Secretolin
Vitrum
ATC V04CK01
CID 16129665
CAS 001393255
SMILES CC(C)C[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC2=NC=CN2)[C@H](C)O)[C@H](C)O)C(=O)N[C@@H](C(C)C)C(O)=O
Transporter
AC-No.NameReferences
Q12908Solute carrier family 10 member 215834929
Pancreozymin (cholecystokinin)

Java required.


Information Structure
Name Pancreozymin (cholecystokinin)
Synonyms
CCRIS 3307
Cholecystokinin
Pancreozymin (cholecystokinin)
ATC V04CK02
CID 9833444
CAS 009011976
SMILES CC[C@H](C)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CNC=N1)NC(=O)[C@H](CO)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H]3CCCN3C(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)[C@H](C)CC)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CC4=CNC5=C4C=CC=C5)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC6=CC=CC=C6)C(N)=O)C7=CC=C(OS(O)(=O)=O)C=C7
Formula C49H62N10O16S3
Molweight 1143.27
Atoms 78
LogP 3.8883
Rotatable Bonds 40
H-Bond Donors 0
H-Bond Acceptors 26
CYP interactions
NameRelationsReferences
2C9Inhibitor 15108219
2E1Inhibitor 15108219
Transporter
AC-No.NameReferences
P46059Solute carrier family 15 member 121311026
Q9NPD5OATP816895978
Bentiromide

Java required.


Information Structure
Name Bentiromide
Synonyms
(S)-4-((2-(Benzoylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)benzoic Acid
(S)-p-(alpha-Benzamido-p-hydroxyhydrocinnamamido)benzoic Acid
4-((2-(Benzoylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)benzoic Acid
Bentiromide
Bentiromido
Bentiromidum
Benzoyltyrosyl-p-aminobenzoic Acid
BRN 2910938
Btpaba
Chymex
E-2663
EINECS 253-349-8
N-Benzoyl-L-tyrosyl-p-aminobenzoic Acid
p-((N-Benzoyl-L-tyrosin)amido)benzoic Acid
PFT
ATC V04CK03
CID 2329
CAS 037106971
SMILES OC(=O)C1=CC=C(NC(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)C3=CC=CC=C3)C=C1
Formula C23H20N2O5
Molweight 404.415
Atoms 30
LogP 3.5341
Rotatable Bonds 9
H-Bond Donors 0
H-Bond Acceptors 7
Transporter
AC-No.NameReferences
P46059Solute carrier family 15 member 121311026
Q9NPD5OATP816895978