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Angustmycin A chemical structure, C11H13N5O4, CAS 2004-04-8
2D chemical structure

Key facts

What buyers check first

CAS number
2004-04-8
Formula
C11H13N5O4
Molar mass
279.26 g/mol
EC number
687-357-1
HS code
293499
Category
Heterocyclic building blocks

What is Angustmycin A?

Plain description, key identifiers and synonyms

Decoyinine is a member of 6-aminopurines.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2R,3R,4S)-2-(6-aminopurin-9-yl)-2-(hydroxymethyl)-5-methylideneoxolane-3,4-diol
CAS number
2004-04-8 CAS number cross-checked
EC number
687-357-1
Molecular formula
C11H13N5O4
InChIKey
UZSSGAOAYPICBZ-SOCHQFKDSA-N
InChI
InChI=1S/C11H13N5O4/c1-5-7(18)8(19)11(2-17,20-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-4,7-8,17-19H,1-2H2,(H2,12,13,14)/t7-,8-,11-/m1/s1
Canonical SMILES
C=C1OC(CO)(n2cnc3c(N)ncnc32)C(O)C1O
Isomeric SMILES
C=C1[C@H]([C@H]([C@](O1)(CO)N2C=NC3=C(N=CN=C32)N)O)O

Synonyms

  • decoyinine
  • Decoyinin
  • Antibiotic A 14
  • (2R,3R,4S)-2-(6-aminopurin-9-yl)-2-(hydroxymethyl)-5-methylideneoxolane-3,4-diol
  • 9H-Purin-6-amine, 9-(6-deoxy-beta-D-erythro-hex-5-en-2-ulofuranosyl)-
  • 9-(6-Deoxy-beta-D-erythro-hex-5-en-2-ulofuranosyl)-9H-purin-6-amine
  • 9-(6-Deoxy-beta-D-erythro-hex-5-enulofuranosyl)adenine
  • Adenine, 9-(6-deoxy-beta-D-erythro-hex-5-enulofuranosyl)-
  • 9-(Tetrahydro-3,4-dihydroxy-2-(hydroxymethyl)-5-methylene-2-furyl)adenine
  • Adenine, 9-(tetrahydro-3,4-dihydroxy-2-(hydroxymethyl)-5-methylene-2-furyl)-
  • 2-(6-aminopurin-9-yl)-2-(hydroxymethyl)-5-methylideneoxolane-3,4-diol
  • (2R,3R,4S)-2-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)-5-methylideneoxolane-3,4-diol
  • (2R,3R,4S)-2-(6-Amino-9H-purin-9-yl)-2-(hydroxymethyl)-5-methylenetetrahydrofuran-3,4-diol
  • Decomycin, U-7984, AI3-50816, Angustmycin A
  • 2-(6-Amino-9H-purin-9-yl)-6-deoxy-beta-D-erythro-hex-5-en-2-ulofuranosyl
  • (2R,3R,4S)-2-(6-aminopurin-9-yl)-2-(hydroxymethyl)-5-methylene-tetrahydrofuran-3,4-diol

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
279.26 g/molcalc.
Exact mass
279.0968 Dacalc.
LogP (octanol/water)
-1.68calc.
Topological polar surface area
139.5 ร…ยฒcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
2calc.
Heavy atoms
20calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.36calc.
Formal charge
0calc.
Stereocentres
3calc.
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, C=C1CCC(n2cnc3cncnc32)O1

C=C1CCC(n2cnc3cncnc32)O1

3 rings, 15 atoms.

12 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H315Causes skin irritation.
  • H319Causes serious eye irritation.
  • H335May cause respiratory irritation.
Precautionary statements (16)
  • P261Avoid breathing dust, fume, gas, mist, vapours or spray.
  • P264Wash skin thoroughly after handling.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P271Use only outdoors or in a well-ventilated area.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P302 + P352If on skin: Wash with plenty of water.
  • P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
  • P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P319Get medical help if you feel unwell.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P332 + P317If skin irritation occurs: Get medical help.
  • P337 + P317If eye irritation persists: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • P403 + P233Store in a well-ventilated place. Keep container tightly closed.
  • P405Store locked up.
  • P501Dispose of contents and container in accordance with local regulations.

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

Full safety data and first aid

Angustmycin A suppliers

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Where suppliers are based

3 suppliers in 1 country

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Angustmycin A price

Indicative price range per kg from live supplier offers

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

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Uses and applications

What the substance is used for, by industry and function

Pharmacological actions

  • Anti-Bacterial Agents

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

Frequently asked questions

Quick answers about Angustmycin A, based on the data on this page

What is Angustmycin A?

Decoyinine is a member of 6-aminopurines.

What is the CAS number of Angustmycin A?

The CAS registry number of Angustmycin A is 2004-04-8.

What is the molecular formula and weight of Angustmycin A?

The molecular formula of Angustmycin A is C11H13N5O4 and its molar mass is 279.26 g/mol.

What is Angustmycin A used for?

Known uses and roles of Angustmycin A include building blocks in research and laboratory, screening compounds in research and laboratory and anti-bacterial agents.

Is Angustmycin A hazardous?

Angustmycin A carries the GHS signal word "Warning". Main hazards: causes skin irritation, causes serious eye irritation, may cause respiratory irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Angustmycin A?

Angustmycin A is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclicโ€ฆ). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Angustmycin A?

CompoundList lists 3 suppliers of Angustmycin A in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Angustmycin A?

Suppliers quote Angustmycin A 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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