Tubacin

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Basic information
Standard English name
Cas No. 537049-40-4
Alias N1-(4-((2R,4R,6S)-4-(((4,5-diphenyloxazol-2-yl)thio)methyl)-6-(4-(hydroxymethyl)phenyl)-1,3-dioxan-2-yl)phenyl)-N8-hydroxyoctanediamide
Canonical Smiles ONC(=O)CCCCCCC(=O)NC1=CC=C(C=C1)[C@H]1O[C@@H](CSC2=NC(C3=CC=CC=C3)=C(O2)C2=CC=CC=C2)C[C@H](O1)C1=CC=C(CO)C=C1
MDL No. MFCD18452824
Exact Mass 721.28217
Smiles OCC(C=C1)=CC=C1[C@H]2O[C@@H](C3=CC=C(NC(CCCCCCC(NO)=O)=O)C=C3)O[C@@H](CSC4=NC(C5=CC=CC=C5)=C(C6=CC=CC=C6)O4)C2
Security information
Character
Storage Condition
Melting Point 155 - 157°C
Boiling Point
Flash Point
Chemical Stability
Density
Vapor Pressure
GHS
Signal Word
Dangerous Goods GHS07
Hazard Category H302
Hazard Codes
Prevention Guidelines
Hazard Statements
Safety Instructions P280;P305+P351+P338
Water Solubility
Storage Temp.
Hazardous Decomposition Products
Chirality
Biological Activity
Physicochemical Propertie
Transport Condition
HS Code
UN No.
Feature Warning
Useage
Inchi InChI=1S/C41H43N3O7S/c45-26-28-17-19-29(20-18-28)35-25-34(27-52-41-43-38(30-11-5-3-6-12-30)39(51-41)31-13-7-4-8-14-31)49-40(50-35)32-21-23-33(24-22-32)42-36(46)15-9-1-2-10-16-37(47)44-48/h3-8,11-14,17-24,34-35,40,45,48H,1-2,9-10,15-16,25-27H2,(H,42,46)(H,44,47)/t34-,35+,40+/m1/s1
InchiKey BHUZLJOUHMBZQY-YXQOSMAKSA-N
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