生物素基-腺苷二磷酸
TL;DR: 生物素基-腺苷二磷酸 (CAS 100844-62-0) is a chemical compound with molecular formula C28H45N9O13P2S and molecular weight 809.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
生物素基-腺苷二磷酸
[3,4-dihydroxy-5-[6-[[2-oxo-2-[6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexylamino]ethyl]amino]purin-9-yl]oxolan-2-yl]methyl phosphono hydrogen phosphate
Also Known As: Biotinyl-ADP, Biotinyl-adenoside diphosphate, [3,4-dihydroxy-5-[6-[[2-oxo-2-[6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexylamino]ethyl]amino]purin-9-yl]oxolan-2-yl]methyl phosphono hydrogen phosphate, 2-orthofluorophenyl-2H-1,4-benzothiazine-3-thione-4-acetic acid, Hydrazinecarbodithioic acid, 2-(2-pyridinylmethyl)-, methyl ester
| Molecular Formula | C28H45N9O13P2S |
|---|---|
| Molecular Weight | 809.23 g/mol |
| LogP | -3.3 |
| Topological Polar Surface Area | 343.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 21 |
| Exact Mass | 809.2333 |
| Heavy Atoms | 53 |
| Complexity | 1360.0 |
Chemical Identifiers
| CAS Number | 100844-62-0 |
|---|---|
| SMILES | C1C2C(C(S1)CCCCC(=O)NCCCCCCNC(=O)CNC3=C4C(=NC=N3)N(C=N4)C5C(C(C(O5)COP(=O)(O)OP(=O)(O)O)O)O)NC(=O)N2 |
| InChIKey | DMZDLCTXFPJCIZ-UHFFFAOYSA-N |
Product Overview
生物素基-腺苷二磷酸 (CAS 100844-62-0), with molecular formula C28H45N9O13P2S and molecular weight 809.23 g/mol. IUPAC: [3,4-dihydroxy-5-[6-[[2-oxo-2-[6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexylamino]ethyl]amino]purin-9-yl]oxolan-2-yl]methyl phosphono hydrogen phosphate.
Chemical Property Profile of 生物素基-腺苷二磷酸
Property Insights of 生物素基-腺苷二磷酸
The XLogP value of -3.3 indicates that 生物素基-腺苷二磷酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 343.0 Ų indicates high polarity, suggesting 生物素基-腺苷二磷酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 生物素基-腺苷二磷酸 has 10 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 生物素基-腺苷二磷酸?
The CAS number of 生物素基-腺苷二磷酸 is 100844-62-0.
What is the molecular formula of 生物素基-腺苷二磷酸?
The molecular formula of 生物素基-腺苷二磷酸 is C28H45N9O13P2S.
What is the molecular weight of 生物素基-腺苷二磷酸?
The molecular weight of 生物素基-腺苷二磷酸 is 809.23 g/mol.
Where can I buy 生物素基-腺苷二磷酸?
You can request a quote for 生物素基-腺苷二磷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 生物素基-腺苷二磷酸?
Yes, KEHONG BIO provides custom synthesis services for 生物素基-腺苷二磷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.