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11α,12α-Bis(acetyloxy)-15-[(Z)-1-hydroxy-2-methylpropylidene]phragmalin30-acetate3-(2-hydroxy-2-methylbutyrate)
11α,12α-Bis(acetyloxy)-15-[(Z)-1-hydroxy-2-methylpropylidene]phragmalin30-acetate3-(2-hydroxy-2-methylbutyrate)
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![11α,12α-Bis(acetyloxy)-15-[(Z)-1-hydroxy-2-methylpropylidene]phragmalin30-acetate3-(2-hydroxy-2-methylbutyrate) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/23300d0958404cf0abf431d72fced63d.png "11α,12α-Bis(acetyloxy)-15-[(Z)-1-hydroxy-2-methylpropylidene]phragmalin30-acetate3-(2-hydroxy-2-methylbutyrate)")
11α,12α-Bis(acetyloxy)-15-[(Z)-1-hydroxy-2-methylpropylidene]phragmalin30-acetate3-(2-hydroxy-2-methylbutyrate)
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CAS No:
90930-99-7
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Formula:
C44H56O19
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Chemical Name:
11α,12α-Bis(acetyloxy)-15-[(Z)-1-hydroxy-2-methylpropylidene]phragmalin30-acetate3-(2-hydroxy-2-methylbutyrate)
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Synonyms:
Bussein G
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CAS No:
11α,12α-Bis(acetyloxy)-15-[(Z)-1-hydroxy-2-methylpropylidene]phragmalin30-acetate3-(2-hydroxy-2-methylbutyrate) Basic Attributes
888.90404
888.342
Computed Properties
Molecular Weight:888.9
XLogP3:2.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:15
Exact Mass:888.34157955
Monoisotopic Mass:888.34157955
Topological Polar Surface Area:259
Heavy Atom Count:63
Complexity:2090
Defined Atom Stereocenter Count:15
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 11α,12α-Bis(acetyloxy)-15-[(Z)-1-hydroxy-2-methylpropylidene]phragmalin30-acetate3-(2-hydroxy-2-methylbutyrate)
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