Products for Research Use Only
RegisterLogin

Napsamycin B

CAT: 0931-TN9951-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-TN9951-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
144408-86-6
Target
Antibacterial, Antibiotic
Related Pathways
Microbiology/Virology
Bioactivity
Napsamycin B is an antibiotic. Napsamycin D exhibits antibacterial activity specifically against Pseudomonas aeruginosa and other Pseudomonas species, while demonstrating weaker antibacterial effects on other Gram-positive and Gram-negative bacteria.
Smiles
O=C1C=CN(C(=O)N1)C2OC(=CNC(=O)C(NC(=O)C(NC(=O)NC(C(=O)O)CC=3C=CC=C(O)C3)CCSC)C(N(C(=O)C4NC(C5=CC=C(O)C=C5C4)C)C)C)CC2O
Molecular Formula
C40H50N8O12S
Molecular Weight
866.936
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Napsamycin B

Napsamycin B is a peptide.

CAS Number144408-86-6
PubChem CID145720601
IUPAC Name2-[[1-[[1-[[5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-2-ylidene]methylamino]-3-[(6-hydroxy-1-methyl-1,2,3,4-tetrahydroisoquinoline-3-carbonyl)-methylamino]-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamoylamino]-3-(3-hydroxyphenyl)propanoic acid
Molecular FormulaC40H50N8O12S
Molecular Weight866.9
XLogP-2.1
Topological Polar Surface Area314
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count14
Rotatable Bond Count16
Heavy Atom Count61
Formal Charge0
Complexity1700
SMILES
CC1C2=C(CC(N1)C(=O)N(C)C(C)C(C(=O)NC=C3CC(C(O3)N4C=CC(=O)NC4=O)O)NC(=O)C(CCSC)NC(=O)NC(CC5=CC(=CC=C5)O)C(=O)O)C=C(C=C2)O
InChI
InChI=1S/C40H50N8O12S/c1-20-27-9-8-25(50)16-23(27)17-29(42-20)36(55)47(3)21(2)33(35(54)41-19-26-18-31(51)37(60-26)48-12-10-32(52)45-40(48)59)46-34(53)28(11-13-61-4)43-39(58)44-30(38(56)57)15-22-6-5-7-24(49)14-22/h5-10,12,14,16,19-21,28-31,33,37,42,49-51H,11,13,15,17-18H2,1-4H3,(H,41,54)(H,46,53)(H,56,57)(H2,43,44,58)(H,45,52,59)
InChIKey
UTIFRWPUJPPZEZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Napsamycin B
CAS: 144408-86-6
CID: 145720601
Formula: C40H50N8O12S
MW: 866.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight866.9
XLogP3-2.1
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count14
Rotatable Bond Count16
Exact Mass866.32689023
Monoisotopic Mass866.32689023
Topological Polar Surface Area314 Ų
Heavy Atom Count61
Formal Charge0
Complexity1700
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count8
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TN9912-01Napsamycin A
TN10393-01Napsamycin D
TN10377-01Napsamycin C
T37756-01Phloxine B
T125095-01Monocillinol B
T124005-01Gingerglycolipid B
T34326-01Ridaifen-B
T124328-01Sibiriquinone B
T124366-01Psilostachyin B
T124518-01Senampeline B

Alternative Products

CatalogName
HY-N14845Napsamycin A
HY-N14851Napsamycin C
HY-N14852Napsamycin D
GTR19255323-01Napsamycin B

Popular Products