MedKoo Cat#: 576239 | Name: Hematoporphyrin diphenyl ether

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Hematoporphyrin diphenyl ether is an iron-free derivative of heme with 4 methyl groups, 2 hydroxyethyl groups, and 2 propionic acid groups attached to the pyrrole rings. Some of these photosensitizing agents are used in the phototherapy of malignant neoplasms.

Chemical Structure

Hematoporphyrin diphenyl ether
Hematoporphyrin diphenyl ether
CAS#119052-81-2

Theoretical Analysis

MedKoo Cat#: 576239

Name: Hematoporphyrin diphenyl ether

CAS#: 119052-81-2

Chemical Formula: C46H46N4O6

Exact Mass: 750.3417

Molecular Weight: 750.90

Elemental Analysis: C, 73.58; H, 6.18; N, 7.46; O, 12.78

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
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Synonym
Hematoporphyrin diphenyl ether; HP-Dpe
IUPAC/Chemical Name
21H,23H-Porphine-2,18-dipropanoic acid, 3,7,12,17-tetramethyl-8,13-bis(1-phenoxyethyl)-
InChi Key
XYRLKLUDGTUQFR-AZPDBEIKSA-N
InChi Code
InChI=1S/C46H46N4O6/c1-25-33(17-19-43(51)52)39-24-40-34(18-20-44(53)54)26(2)36(48-40)22-41-46(30(6)56-32-15-11-8-12-16-32)28(4)38(50-41)23-42-45(27(3)37(49-42)21-35(25)47-39)29(5)55-31-13-9-7-10-14-31/h7-16,21-24,29-30,47,50H,17-20H2,1-6H3,(H,51,52)(H,53,54)/b35-21-,36-22-,37-21-,38-23-,39-24-,40-24-,41-22-,42-23-
SMILES Code
CC(Oc1ccccc1)C2=C(C)c3cc4nc(cc5[nH]c(cc6nc(cc2[nH]3)c(C)c6CCC(=O)O)c(CCC(=O)O)c5C)c(C)c4C(C)Oc7ccccc7
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 750.90 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1. Kessel D. Hematoporphyrin and HPD: photophysics, photochemistry and phototherapy. Photochem Photobiol. 1984 Jun;39(6):851-9. doi: 10.1111/j.1751-1097.1984.tb08871.x. PMID: 6235529. 2. Lei TC, Glazner GF, Duffy M, Scherrer L, Pendyala S, Li B, Wang X, Wang H, Huang Z. Optical properties of hematoporphyrin monomethyl ether (HMME), a PDT photosensitizer. Photodiagnosis Photodyn Ther. 2012 Sep;9(3):232-42. doi: 10.1016/j.pdpdt.2012.01.003. Epub 2012 Feb 10. PMID: 22959803.