Phenylmethyl (3β)-3-hydroxyolean-12-en-28-oate
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Phenylmethyl (3β)-3-hydroxyolean-12-en-28-oate
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CAS No:
303114-51-4
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Formula:
C37H54O3
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Chemical Name:
Phenylmethyl (3β)-3-hydroxyolean-12-en-28-oate
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Synonyms:
Olean-12-en-28-oic acid,3-hydroxy-,phenylmethyl ester,(3β)-;Phenylmethyl (3β)-3-hydroxyolean-12-en-28-oate;Benzyl oleanolate;Oleanolic acid benzyl ester;2102352-62-3
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CAS No:
Characteristics
46.5
8.89240
1.098 g/cm3
190-192 °C @ Solvent: Ethanol
604.224ºC at 760 mmHg
217.48ºC
Computed Properties
Molecular Weight:546.8
XLogP3:9.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:546.40729558
Monoisotopic Mass:546.40729558
Topological Polar Surface Area:46.5
Heavy Atom Count:40
Complexity:1030
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Phenylmethyl (3β)-3-hydroxyolean-12-en-28-oate
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