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Details

Stereochemistry ABSOLUTE
Molecular Formula C71H110N24O18S.2ClH
Molecular Weight 1692.77
Optical Activity UNSPECIFIED
Defined Stereocenters 12 / 12
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BOMBESIN DIHYDROCHLORIDE

SMILES

Cl.Cl.CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CN=CN1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC2=CNC3=CC=CC=C23)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]4CCC(=O)N4)C(C)C)C(N)=O

InChI

InChIKey=VMJYQBARVAILCT-RDVJJKDBSA-N
InChI=1S/C71H110N24O18S.2ClH/c1-34(2)24-47(92-62(105)43(14-11-22-79-71(76)77)89-64(107)45(15-18-52(72)96)90-63(106)44-17-20-55(99)85-44)61(104)81-31-56(100)87-51(28-54(74)98)69(112)91-46(16-19-53(73)97)65(108)94-49(26-38-29-80-41-13-10-9-12-40(38)41)66(109)84-37(7)60(103)95-58(36(5)6)70(113)82-32-57(101)86-50(27-39-30-78-33-83-39)68(111)93-48(25-35(3)4)67(110)88-42(59(75)102)21-23-114-8;;/h9-10,12-13,29-30,33-37,42-51,58,80H,11,14-28,31-32H2,1-8H3,(H2,72,96)(H2,73,97)(H2,74,98)(H2,75,102)(H,78,83)(H,81,104)(H,82,113)(H,84,109)(H,85,99)(H,86,101)(H,87,100)(H,88,110)(H,89,107)(H,90,106)(H,91,112)(H,92,105)(H,93,111)(H,94,108)(H,95,103)(H4,76,77,79);2*1H/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,58-;;/m0../s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C71H110N24O18S
Molecular Weight 1619.848
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 12 / 12
E/Z Centers 8
Optical Activity UNSPECIFIED

Bombesin (BN), a neuropeptide that originally was purified from the skin of the European frog (Bombina bombina). It has many biological effects including hormone release, stimulation of pancreatic enzyme secretion, gallbladder contraction and bronchoconstriction. Bombesin is a highly specific marker of neuroendocrine differentiation and thus a valuable tumor marker. It activates three different G-protein-coupled receptors known as BBR1, -2, and -3.

Approval Year

PubMed

PubMed

TitleDatePubMed
Bombesin in human neuroendocrine (NE) neoplasms.
1985
The effect of bombesin, cholecystokinin, gastrin, and their antagonists on proliferation of pancreatic cancer cell lines.
1999 Dec
Bombesin-like peptides: studies on food intake and social behaviour with receptor knock-out mice.
2000 Nov
Regulation and signaling of human bombesin receptors and their biological effects.
2009 Feb
Substance Class Chemical
Created
by admin
on Sat Dec 16 05:31:01 GMT 2023
Edited
by admin
on Sat Dec 16 05:31:01 GMT 2023
Record UNII
7LN1X0A80V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BOMBESIN DIHYDROCHLORIDE
Common Name English
BOMBESIN HYDROCHLORIDE
MI  
Common Name English
ALYTESIN, 2-L-GLUTAMINE-6-L-ASPARAGINE-, DIHYDROCHLORIDE
Common Name English
BOMBESIN, DIHYDROCHLORIDE
Common Name English
BOMBESIN HYDROCHLORIDE [MI]
Common Name English
Code System Code Type Description
DRUG BANK
DBSALT002057
Created by admin on Sat Dec 16 05:31:01 GMT 2023 , Edited by admin on Sat Dec 16 05:31:01 GMT 2023
PRIMARY
CAS
33910-70-2
Created by admin on Sat Dec 16 05:31:01 GMT 2023 , Edited by admin on Sat Dec 16 05:31:01 GMT 2023
PRIMARY
MERCK INDEX
m2602
Created by admin on Sat Dec 16 05:31:01 GMT 2023 , Edited by admin on Sat Dec 16 05:31:01 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID10187533
Created by admin on Sat Dec 16 05:31:01 GMT 2023 , Edited by admin on Sat Dec 16 05:31:01 GMT 2023
PRIMARY
FDA UNII
7LN1X0A80V
Created by admin on Sat Dec 16 05:31:01 GMT 2023 , Edited by admin on Sat Dec 16 05:31:01 GMT 2023
PRIMARY
PUBCHEM
71587120
Created by admin on Sat Dec 16 05:31:01 GMT 2023 , Edited by admin on Sat Dec 16 05:31:01 GMT 2023
PRIMARY