Products for Research Use Only
RegisterLogin

BigLEN (rat)

CAT: 0931-TP2074Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-TP2074Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
369377-66-2
Target
GPCR
Related Pathways
Endocrinology/Hormones, GPCR/G Protein
Bioactivity
Potent GPR171 agonist (EC50 = 1.6 nM) . ProSAAS-derived peptide. Regulates body weight in mice and promotes the outgrowth of neurites in Neuro2A cells.
Smiles
C(=O)([C@H]1N(C([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC(=O)[C@H]2N(C([C@@H](NC([C@@H](NC(=O)[C@H]3N(C([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H](CC(C)C)N)=O)CCC(O)=O)=O)CC(N)=O)=O)CO)=O)CO)=O)CCC3)CCC(N)=O)=O)C)=O)CCC2)C)=O)CCCNC(=N)N)=O)CCCNC(=N)N)=O)CC(C)C)=O)CC(C)C)=O)CCC1)N4[C@H](C(O)=O)CCC4
Molecular Formula
C76H128N24O23
Molecular Weight
1746
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

BigLEN(rat)
CAS Number369377-66-2
PubChem CID131648251
IUPAC Name(2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-5-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Molecular FormulaC76H128N24O23
Molecular Weight1746.0
XLogP-9.3
Topological Polar Surface Area757
Hydrogen Bond Donor Count22
Hydrogen Bond Acceptor Count26
Rotatable Bond Count51
Heavy Atom Count123
Formal Charge0
Complexity3820
SMILES
C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)N
InChI
InChI=1S/C76H128N24O23/c1-37(2)31-42(77)60(108)89-46(22-24-58(105)106)64(112)93-48(34-57(79)104)66(114)95-50(35-101)67(115)96-51(36-102)72(120)98-28-12-18-53(98)69(117)91-45(21-23-56(78)103)61(109)87-41(8)70(118)97-27-11-17-52(97)68(116)86-40(7)59(107)88-43(15-9-25-84-75(80)81)62(110)90-44(16-10-26-85-76(82)83)63(111)92-47(32-38(3)4)65(113)94-49(33-39(5)6)71(119)99-29-13-19-54(99)73(121)100-30-14-20-55(100)74(122)123/h37-55,101-102H,9-36,77H2,1-8H3,(H2,78,103)(H2,79,104)(H,86,116)(H,87,109)(H,88,107)(H,89,108)(H,90,110)(H,91,117)(H,92,111)(H,93,112)(H,94,113)(H,95,114)(H,96,115)(H,105,106)(H,122,123)(H4,80,81,84)(H4,82,83,85)/t40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-/m0/s1
InChIKey
IPOOBASOJFKEAK-GTJGPZIJSA-N
Chemical Structure
2D Structure
2D structure of BigLEN(rat)
CAS: 369377-66-2
CID: 131648251
Formula: C76H128N24O23
MW: 1746.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1746.0
XLogP3-9.3
Hydrogen Bond Donor Count22
Hydrogen Bond Acceptor Count26
Rotatable Bond Count51
Exact Mass1744.95841643
Monoisotopic Mass1744.95841643
Topological Polar Surface Area757 Ų
Heavy Atom Count123
Formal Charge0
Complexity3820
Isotope Atom Count0
Defined Atom Stereocenter Count16
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TP2073BigLEN (mouse)
T82885-01BigLEN (mouse) TFA
TP2073L-01BigLEN (mouse) acetate
TP1901Hemopressin (rat)
TP1597-01Secretoneurin, rat
T82317-01GIP, rat
T81406-01Preptin (rat)
TRP-00275-01Rat Laminin
TP2233α-CGRP, rat
T16553-01Pneumadin, rat

Alternative Products

CatalogName
GTR19029162BigLEN (rat)
A23455-1BigLEN (rat) 1mg
MBS5817949BigLEN (rat) TFA
HY-P2155ABigLEN (rat) (TFA)
A23455-5BigLEN (rat) 5mg
BVA03669-01BigLEN (mouse)
HY-P2210A-01BigLEN (mouse) (TFA)
GTR19034779-01BigLEN (mouse) TFA
GTR18918646-01BigLEN (mouse) acetate
6304/1BigLEN (mouse) 1 mg

Popular Products