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Screening compounds

PC-M5'

CAS 133613-75-9Formula C29H37NO5Molar mass 479.62 g/mol
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PC-M5' chemical structure, C29H37NO5, CAS 133613-75-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
133613-75-9
Formula
C29H37NO5
Molar mass
479.62 g/mol
HS code
293499
Category
Screening compounds

What is PC-M5'?

Plain description, key identifiers and synonyms

PC-M5' is an organic heterotricyclic compound and an organooxygen compound.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1S,2R,5S,7S,8R,11S,14S)-11-hydroxy-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-9,16(24),17,19,21-pentaen-8-yl] acetate
CAS number
133613-75-9
Molecular formula
C29H37NO5
InChIKey
IMABPJDBODVJSN-HKZMUHMQSA-N
InChI
InChI=1S/C29H37NO5/c1-16(31)34-23-15-20-22(35-25(23)26(2,3)32)11-12-27(4)28(5)17(10-13-29(20,27)33)14-19-18-8-6-7-9-21(18)30-24(19)28/h6-9,15,17,22-23,25,30,32-33H,10-14H2,1-5H3/t17-,22-,23+,25-,27+,28+,29+/m0/s1
Canonical SMILES
CC(=O)OC1C=C2C(CCC3(C)C2(O)CCC2Cc4c([nH]c5ccccc45)C23C)OC1C(C)(C)O
Isomeric SMILES
CC(=O)O[C@@H]1C=C2[C@H](CC[C@]3([C@]2(CC[C@@H]4[C@@]3(C5=C(C4)C6=CC=CC=C6N5)C)O)C)O[C@@H]1C(C)(C)O

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
479.62 g/molcalc.
Exact mass
479.2672 Dacalc.
LogP (octanol/water)
4.32calc.
Topological polar surface area
91.78 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
2calc.
Heavy atoms
35calc.
Rings
6calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.62calc.
Formal charge
0calc.
Stereocentres
7calc.
Lipinski rule of five
Passes (0 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, C1=C2C(CCC3C2CCC2Cc4c([nH]c5ccccc45)C23)OCC1

C1=C2C(CCC3C2CCC2Cc4c([nH]c5ccccc45)C23)OCC1

6 rings, 24 atoms.

3 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.

PC-M5' suppliers

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

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PC-M5' price

Indicative price range per kg from live supplier offers

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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 PC-M5' is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for PC-M5' is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about PC-M5', based on the data on this page

What is PC-M5'?

PC-M5' is an organic heterotricyclic compound and an organooxygen compound.

What is the CAS number of PC-M5'?

The CAS registry number of PC-M5' is 133613-75-9.

What is the molecular formula and weight of PC-M5'?

The molecular formula of PC-M5' is C29H37NO5 and its molar mass is 479.62 g/mol.

What is PC-M5' used for?

Known uses and roles of PC-M5' include building blocks in research and laboratory and screening compounds in research and laboratory.

Is PC-M5' hazardous?

No GHS hazard classification for PC-M5' 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 PC-M5'?

PC-M5' is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy PC-M5'?

Post a free request on CompoundList and suppliers of PC-M5' will send you quotes. Your contact details stay private until you accept a quote.

What is the price of PC-M5'?

Suppliers quote PC-M5' 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 PC-M5'

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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