Heme d1
TL;DR: Heme d1 (CAS 59948-35-5) is a chemical compound with molecular formula C34H30FeN4O10 and molecular weight 710.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[18-[(E)-2-carboxylatoethenyl]-8,13-bis(carboxylatomethyl)-3,8,13,17-tetramethyl-7,12-dioxoporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(2+)
Also Known As: Heme d1, Heme d(1), 3-[18-[(E)-2-carboxylatoethenyl]-8,13-bis(carboxylatomethyl)-3,8,13,17-tetramethyl-7,12-dioxoporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(2+), Ferrate(4-), (13-(2-carboxyethenyl)-17-(2-carboxyethyl)-7,8-dihydro-7,8-bis(hydroxymethyl)-7,8,12,18-tetramethyl-21H,23H-porphine-2,3-dicarboxylato(6-)-N21,N22,N23,N24)-, tetrahydrogen, 3-[18-[(E)-2-carboxylatoethenyl]-8,13-bis(carboxylatomethyl)-3,8,13,17-tetramethyl-12-oxido-7-oxoporphyrin-21-id-2-yl]propanoate,hydron,iron(2+)
| Molecular Formula | C34H30FeN4O10 |
|---|---|
| Molecular Weight | 710.13 g/mol |
| LogP | -1.35586 |
| Topological Polar Surface Area | 248.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 710.1311 |
| Heavy Atoms | 49 |
| Complexity | 2185.0322 |
Chemical Identifiers
| CAS Number | 59948-35-5 |
|---|---|
| SMILES | [H+].[H+].[H+].[H+].CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(C(=O)C(=N4)C=C5C(C(=O)C(=N5)C=C1[N-]2)(C)CC(=O)[O-])(C)CC(=O)[O-])C)/C=C/C(=O)[O-])CCC(=O)[O-].[Fe+2] |
Product Overview
Heme d1 (CAS 59948-35-5), with molecular formula C34H30FeN4O10 and molecular weight 710.13 g/mol. IUPAC: 3-[18-[(E)-2-carboxylatoethenyl]-8,13-bis(carboxylatomethyl)-3,8,13,17-tetramethyl-7,12-dioxoporphyrin-21,24-diid-2-yl]propanoate;hydron;iron(2+).
Chemical Property Profile of Heme d1
Property Insights of Heme d1
The XLogP value of -1.35586 indicates that Heme d1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 248.64 Ų indicates high polarity, suggesting Heme d1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Heme d1 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Heme d1?
The CAS number of Heme d1 is 59948-35-5.
What is the molecular formula of Heme d1?
The molecular formula of Heme d1 is C34H30FeN4O10.
What is the molecular weight of Heme d1?
The molecular weight of Heme d1 is 710.13 g/mol.
Where can I buy Heme d1?
You can request a quote for Heme d1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heme d1?
Yes, KEHONG BIO provides custom synthesis services for Heme d1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.