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Azamulin

Azamulin structure

CAS No:
76530-44-4
Formula:
C24H38N4O4S
Chemical Name:
Azamulin
Synonyms:
SA 85530b;14-O-(5-(2-Amino1,3,4-triazolyl)thioacetyl)dihydromutilin;Antibiotic TDM 85-530;Azamulin;[(5-Amino-1H-1,2,4-triazol-3-yl)thio]acetic acid (3aS,4R,5S,6R,8R,9R,9aR,10R)-6-ethyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH-cyclopentacycloocten-8-yl ester;TMD 85-530, SA 85530b

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Description

White Solid

Azamulin Basic Attributes

Molecular Weight：

478.6 g/mol

Exact Mass：

478.26100

Characteristics

PSA：

156.49000

XLogP3：

4.19070

Appearance：

white to beige

Density：

1.27g/cm3

Melting Point：

128-130°C

Boiling Point：

659.4ºC at 760 mmHg

Flash Point：

352.6ºC

Refractive Index：

1.59

Water Solubility：

DMSO: soluble 10mg/mL (clear solution)

Storage Conditions：

-20°C Freezer

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

Marks：

Stability/Shelf Life：

Store at -200C.

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

azamulin

Azamulin Use and Manufacturing

It is ahighly selective human CYP3A4 inhibitor. A mutilin derivative

Computed Properties

Molecular Weight:478.6
XLogP3:4.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:478.26137688
Monoisotopic Mass:478.26137688
Topological Polar Surface Area:157
Heavy Atom Count:33
Complexity:786
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Azamulin

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties

Azamulin

SDS

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