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Nucleosides and nucleotides

Orb2937626

CAS 2365165-54-2Formula C30H36N15O19P3Molar mass 1,003.63 g/mol
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Orb2937626 chemical structure, C30H36N15O19P3, CAS 2365165-54-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2365165-54-2
Formula
C30H36N15O19P3
Molar mass
1,003.63 g/mol
HS code
293499
Category
Nucleosides and nucleotides

What is Orb2937626?

Plain description, key identifiers and synonyms

Orb2937626 is a chemical substance with the molecular formula C30H36N15O19P3 and a molar mass of 1,003.63 g/mol. Its CAS registry number is 2365165-54-2. The IUPAC name is 2-amino-9-[(1S,6R,8R,9R,10S,15R,17R,18R,19S,24R,26R,27R)-17,26-bis(6-aminopurin-9-yl)-3,9,12,18,21,27-hexahydroxy-3,12,21-trioxo-2,4,7,11,13,16,20,22,25-nonaoxa-3λ5,12λ5,21λ5-triphosphatetracyclo[22.3.0.06,10.015,19]heptacosan-8-yl]-1H-purin-6-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-amino-9-[(1S,6R,8R,9R,10S,15R,17R,18R,19S,24R,26R,27R)-17,26-bis(6-aminopurin-9-yl)-3,9,12,18,21,27-hexahydroxy-3,12,21-trioxo-2,4,7,11,13,16,20,22,25-nonaoxa-3λ5,12λ5,21λ5-triphosphatetracyclo[22.3.0.06,10.015,19]heptacosan-8-yl]-1H-purin-6-one
CAS number
2365165-54-2
Molecular formula
C30H36N15O19P3
InChIKey
OCQIWYNXZJSERX-ZQWUJQRXSA-N
InChI
InChI=1S/C30H36N15O19P3/c31-21-12-23(36-4-34-21)43(6-38-12)27-15(46)18-10(60-27)2-57-67(54,55)64-20-11(61-29(17(20)48)45-8-40-14-25(45)41-30(33)42-26(14)49)3-58-66(52,53)63-19-9(1-56-65(50,51)62-18)59-28(16(19)47)44-7-39-13-22(32)35-5-37-24(13)44/h4-11,15-20,27-29,46-48H,1-3H2,(H,50,51)(H,52,53)(H,54,55)(H2,31,34,36)(H2,32,35,37)(H3,33,41,42,49)/t9-,10-,11-,15-,16-,17-,18-,19-,20-,27-,28-,29-/m1/s1
Canonical SMILES
Nc1nc2c(ncn2C2OC3COP(=O)(O)OC4C(COP(=O)(O)OC5C(COP(=O)(O)OC3C2O)OC(n2cnc3c(N)ncnc32)C5O)OC(n2cnc3c(N)ncnc32)C4O)c(=O)[nH]1
Isomeric SMILES
C1[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C3N=C(NC4=O)N)O)OP(=O)(OC[C@@H]5[C@H]([C@H]([C@@H](O5)N6C=NC7=C(N=CN=C76)N)O)OP(=O)(OC[C@@H]8[C@H]([C@H]([C@@H](O8)N9C=NC2=C(N=CN=C29)N)O)OP(=O)(O1)O)O)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
1,003.63 g/molcalc.
Exact mass
1,003.1525 Dacalc.
LogP (octanol/water)
-3.16calc.
Topological polar surface area
484.5 Ųcalc.
Hydrogen bond donors
10calc.
Hydrogen bond acceptors
27calc.
Rotatable bonds
3calc.
Heavy atoms
67calc.
Rings
10calc.
Aromatic rings
6calc.
Fraction sp3 carbons
0.5calc.
Formal charge
0calc.
Stereocentres
15calc.
Lipinski rule of five
Fails (3 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, O=c1[nH]cnc2c1ncn2C1CC2O[PH](=O)OCC3OC(n4cnc5cncnc54)CC3O[PH](=O)OCC3OC(n4cnc5cncnc54)CC3O[PH](=O)OCC2O1

O=c1[nH]cnc2c1ncn2C1CC2O[PH](=O)OCC3OC(n4cnc5cncnc54)CC3O[PH](=O)OCC3OC(n4cnc5cncnc54)CC3O[PH](=O)OCC2O1

10 rings, 58 atoms.

No other chemical in our database has 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.

Orb2937626 suppliers

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Orb2937626 price

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

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 Orb2937626 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 Orb2937626 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Orb2937626, based on the data on this page

What is Orb2937626?

Orb2937626 is a chemical substance with the molecular formula C30H36N15O19P3 and a molar mass of 1,003.63 g/mol. Its CAS registry number is 2365165-54-2.

What is the CAS number of Orb2937626?

The CAS registry number of Orb2937626 is 2365165-54-2.

What is the molecular formula and weight of Orb2937626?

The molecular formula of Orb2937626 is C30H36N15O19P3 and its molar mass is 1,003.63 g/mol.

Is Orb2937626 hazardous?

No GHS hazard classification for Orb2937626 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 Orb2937626?

Orb2937626 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 Orb2937626?

Post a free request on CompoundList and suppliers of Orb2937626 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Orb2937626?

Suppliers quote Orb2937626 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

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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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