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518-34-3

518-34-3 structural image
Product Name: D-Tetrandrine
Formula: C38H42N2O6
Synonyms: (1β)-6,6′,7,12-Tetramethoxy-2,2′-dimethylberbaman
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 245.3 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H300:Acute toxicity,oral
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P405:Store locked up.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 622.7 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 622.30428706 g/mol
Monoisotopic Mass 622.30428706 g/mol
Topological Polar Surface Area 61.9 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 979
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(+)-Tetrandrine is a member of isoquinolines and a bisbenzylisoquinoline alkaloid.