b-dpnh
TL;DR: b-dpnh (CAS 58-68-4) is a chemical compound with molecular formula C21H29N7O14P2 and molecular weight 665.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
b-dpnh
[[(2R,3S,4R,5S)-5-(6-amino-7H-purin-8-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
Also Known As: b-dpnh, Dihydrocozymase, [[(2R,3S,4R,5S)-5-(6-amino-7H-purin-8-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate, Adenosine 5'-(trihydrogen diphosphate), 5'< b-dpnh (CAS 58-68-4), with molecular formula C21H29N7O14P2 and molecular weight 665.12 g/mol. IUPAC: [[(2R,3S,4R,5S)-5-(6-amino-7H-purin-8-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate.
Molecular Formula
C21H29N7O14P2
Molecular Weight
665.12 g/mol
LogP
-5.9
Topological Polar Surface Area
328.0 Ų
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
19
Rotatable Bonds
11
Exact Mass
665.12476
Heavy Atoms
44
Complexity
1230.0
Chemical Identifiers
CAS Number
58-68-4
SMILES
C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)C4=NC5=NC=NC(=C5N4)N)O)O)O)O
InChIKey
ITHLNINGIUMTDS-VJOGCJHKSA-NProduct Overview
Chemical Property Profile of b-dpnh
Property Insights of b-dpnh
The XLogP value of -5.9 indicates that b-dpnh is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 328.0 Ų indicates high polarity, suggesting b-dpnh may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, b-dpnh has 9 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of b-dpnh?
The CAS number of b-dpnh is 58-68-4.
What is the molecular formula of b-dpnh?
The molecular formula of b-dpnh is C21H29N7O14P2.
What is the molecular weight of b-dpnh?
The molecular weight of b-dpnh is 665.12 g/mol.
Where can I buy b-dpnh?
You can request a quote for b-dpnh directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for b-dpnh?
Yes, KEHONG BIO provides custom synthesis services for b-dpnh and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.