CompoundList
Sign in
Heterocyclic building blocks

PHAEOPHYTIN, alpha beta

Formula C55H72N4O6Molar mass 885.20 g/molEC 221-565-1
Get quotes Safety data
PHAEOPHYTIN, alpha beta chemical structure, C55H72N4O6
2D chemical structure

Key facts

What buyers check first

All properties
Formula
C55H72N4O6
Molar mass
885.20 g/mol
EC number
221-565-1
HS code
293399
Category
Heterocyclic building blocks

What is PHAEOPHYTIN, alpha beta?

Plain description, key identifiers and synonyms

PHAEOPHYTIN, alpha beta is a chemical substance with the molecular formula C55H72N4O6 and a molar mass of 885.20 g/mol. The IUPAC name is methyl 16-ethenyl-11-ethyl-12-(hydroxymethylidene)-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-(3,7,11,15-tetramethylhexadec-2-enoxy)propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5(26),6,8,10,13(25),14,16,18(24),19-decaene-3-carboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl 16-ethenyl-11-ethyl-12-(hydroxymethylidene)-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-(3,7,11,15-tetramethylhexadec-2-enoxy)propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5(26),6,8,10,13(25),14,16,18(24),19-decaene-3-carboxylate
EC number
221-565-1
Molecular formula
C55H72N4O6
InChIKey
AMVFDCTXPYHACR-UHFFFAOYSA-N
InChI
InChI=1S/C55H72N4O6/c1-12-38-35(8)42-27-43-36(9)40(23-24-48(61)65-26-25-34(7)22-16-21-33(6)20-15-19-32(5)18-14-17-31(3)4)52(58-43)50-51(55(63)64-11)54(62)49-37(10)44(59-53(49)50)28-46-39(13-2)41(30-60)47(57-46)29-45(38)56-42/h12,25,27-33,36,40,51,58,60H,1,13-24,26H2,2-11H3
SMILES (canonical and isomeric)
CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=CC6=NC(=CC(=N2)C1=CO)C(=C6C)C=C)N5)C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(=O)OC)C

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
885.20 g/molcalc.
Exact mass
884.5452 Dacalc.
LogP (octanol/water)
12.13calc.
Topological polar surface area
139 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
10calc.
Rotatable bonds
20calc.
Heavy atoms
65calc.
Rings
6calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.53calc.
Formal charge
0calc.
Stereocentres
5calc.
Lipinski rule of five
Fails (2 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, C=C1C=C2C=C3C=C4C(=O)CC(=C5CCC(=CC6=NC(=CC1=N2)C=C6)N5)C4=N3

C=C1C=C2C=C3C=C4C(=O)CC(=C5CCC(=CC6=NC(=CC1=N2)C=C6)N5)C4=N3

6 rings, 28 atoms.

17 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

PHAEOPHYTIN, alpha beta suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

No supplier listings yet

Post one free request and suppliers who make or trade PHAEOPHYTIN, alpha beta can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

PHAEOPHYTIN, alpha beta price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code PHAEOPHYTIN, alpha beta is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for PHAEOPHYTIN, alpha beta is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about PHAEOPHYTIN, alpha beta, based on the data on this page

What is PHAEOPHYTIN, alpha beta?

PHAEOPHYTIN, alpha beta is a chemical substance with the molecular formula C55H72N4O6 and a molar mass of 885.20 g/mol.

What is the molecular formula and weight of PHAEOPHYTIN, alpha beta?

The molecular formula of PHAEOPHYTIN, alpha beta is C55H72N4O6 and its molar mass is 885.20 g/mol.

What is PHAEOPHYTIN, alpha beta used for?

Known uses and roles of PHAEOPHYTIN, alpha beta include building blocks in research and laboratory.

Is PHAEOPHYTIN, alpha beta hazardous?

No GHS hazard classification for PHAEOPHYTIN, alpha beta is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of PHAEOPHYTIN, alpha beta?

PHAEOPHYTIN, alpha beta is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy PHAEOPHYTIN, alpha beta?

Post a free request on CompoundList and suppliers of PHAEOPHYTIN, alpha beta will send you quotes. Your contact details stay private until you accept a quote.

What is the price of PHAEOPHYTIN, alpha beta?

Suppliers quote PHAEOPHYTIN, alpha beta on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle PHAEOPHYTIN, alpha beta

Get quotes for PHAEOPHYTIN, alpha beta

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell PHAEOPHYTIN, alpha beta
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of PHAEOPHYTIN, alpha beta with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/phaeophytin-alpha-beta-cid-115011" title="PHAEOPHYTIN, alpha beta structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Heterocyclic building blocks or HS code 293399

Price on request
Free quotes, contact stays private
Get quotes