Betulinicaldehyde
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Betulinicaldehyde
structure -
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CAS No:
13159-28-9
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Formula:
C30H48O2
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Chemical Name:
Betulinicaldehyde
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Synonyms:
Betulinicaldehyde;3beta-Hydroxy-Lup-20(30)-en-28-al;Betunal;Lup-20(29)-en-28-al, 3beta-hydroxy-;Nsc 250423
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CAS No:
Description
Betulinaldehyde(Betunal) belongs to pentacyclic triterpenoids and was reported to exhibit antimicrobial activities against bacteria and fungi, including S. aureus.IC50 value:Target: Betulinaldehyde(Betunal) belongs to pentacyclic triterpenoids that are based on a 30-carbon skeleton comprising four six-membered rings and one five-membered ring. Betulinaldehyde regulates multiple desirable targets which could be further explored in the development of therapeutic agents for the treatment of
Lup-20(29)-en-28-al, 3beta-hydroxy- is a triterpenoid.
Characteristics
37.3
9.07
1.041
183-187 °C(Solv: methanol (67-56-1))
513.9±33.0 °C(Predicted)
217.4±18.0 °C
1.545
Computed Properties
Molecular Weight:440.7
XLogP3:8.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:440.365430770
Monoisotopic Mass:440.365430770
Topological Polar Surface Area:37.3
Heavy Atom Count:32
Complexity:814
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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