Tryglysin B

CAT: 0931-T80410-02Size: 50 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0931-T80410-02Size:50 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

2788817-93-4

Target

Antibacterial

Related Pathways

Microbiology/Virology

Bioactivity

Triglysin B, an antimicrobial peptide, inhibits the growth of other streptococci [1].

Smiles

C([C@H](NC([C@@H](NC([C@@H](NC([C@H](C(C)C)N)=O)CC(N)=O)=O)CS)=O)C(NCC(N[C@H](C(N[C@@H](CC1=CN=CN1)C(O)=O)=O)CCCCN)=O)=O)C=2C=3C(NC2)=CC=CC3

Molecular Formula

C37H54N12O9S

Molecular Weight

842.96

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Tryglysin B

CAS Number	2788817-93-4
PubChem CID	169450620
IUPAC Name	(2S)-2-[[(2S)-6-amino-2-[[2-[[(2S)-2-[[(2R)-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-4-oxobutanoyl]amino]-3-sulfanylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid
Molecular Formula	C37H54N12O9S
Molecular Weight	843.0
XLogP	-4.3
Topological Polar Surface Area	353
Hydrogen Bond Donor Count	13
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	25
Heavy Atom Count	59
Formal Charge	0
Complexity	1480

SMILES

CC(C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC3=CN=CN3)C(=O)O)N

InChI

InChI=1S/C37H54N12O9S/c1-19(2)31(40)36(56)47-26(13-29(39)50)34(54)49-28(17-59)35(55)46-25(11-20-14-42-23-8-4-3-7-22(20)23)32(52)43-16-30(51)45-24(9-5-6-10-38)33(53)48-27(37(57)58)12-21-15-41-18-44-21/h3-4,7-8,14-15,18-19,24-28,31,42,59H,5-6,9-13,16-17,38,40H2,1-2H3,(H2,39,50)(H,41,44)(H,43,52)(H,45,51)(H,46,55)(H,47,56)(H,48,53)(H,49,54)(H,57,58)/t24-,25-,26-,27-,28-,31-/m0/s1

InChIKey

BYRBGTOJMKCWQB-POOCDACNSA-N

Chemical Structure

2D Structure

CAS: 2788817-93-4

CID: 169450620

Formula: C37H54N12O9S

MW: 843.0

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	843.0
XLogP3	-4.3
Hydrogen Bond Donor Count	13
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	25
Exact Mass	842.38574252
Monoisotopic Mass	842.38574252
Topological Polar Surface Area	353 Å²
Heavy Atom Count	59
Formal Charge	0
Complexity	1480
Isotope Atom Count	0
Defined Atom Stereocenter Count	6
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T80409-01	Tryglysin A
TN8067-01	Sinopodophylline B
TN6632	Arisantetralone B
TN4896	Rauvotetraphylline B
T35736-01	Drimentine B
T124832-01	Gnemonol B
T131127-01	Citroside A or B
TN4198	Hemiphroside B
TN1672	Ganolactone B
TN5376	Axinysone B

Alternative Products

Catalog	Name
GTR19061774-01	Tryglysin A
MBS5822069	Tryglysin B

Tryglysin B

Chemical Information

Related Products

Alternative Products

Popular Products