Withanolide B
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Withanolide B
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CAS No:
56973-41-2
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Formula:
C28H38O5
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Chemical Name:
Withanolide B
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Synonyms:
Ergosta-2,24-dien-26-oic acid,6,7-epoxy-5,22-dihydroxy-1-oxo-,δ-lactone,(5α,6α,7α,22R)-;Withanolide B;Lycium substance B
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CAS No:
Safety Information
3
P273, P501
H413
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:454.6
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:454.27192431
Monoisotopic Mass:454.27192431
Topological Polar Surface Area:76.1
Heavy Atom Count:33
Complexity:981
Defined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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