21-Nor-16,17-secodammarane-16,26-dioic acid,20-(acetyloxy)-3-(β-D-glucopyranosyloxy)-23,30-dihydroxy-17-methyl-,di-γ-lactone,(3β,17R,20S,23S,25R)-
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21-Nor-16,17-secodammarane-16,26-dioic acid,20-(acetyloxy)-3-(β-D-glucopyranosyloxy)-23,30-dihydroxy-17-methyl-,di-γ-lactone,(3β,17R,20S,23S,25R)-
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CAS No:
174902-17-1
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Formula:
C38H60O12
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Chemical Name:
21-Nor-16,17-secodammarane-16,26-dioic acid,20-(acetyloxy)-3-(β-D-glucopyranosyloxy)-23,30-dihydroxy-17-methyl-,di-γ-lactone,(3β,17R,20S,23S,25R)-
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Synonyms:
Spiro[furan-3(2H),1′(2′H)-phenanthren]-5(4H)-one,2′-[(1R,2S)-2-(acetyloxy)-1-methyl-3-[(2S,4R)-tetrahydro-4-methyl-5-oxo-2-furanyl]propyl]-7′-(β-D-glucopyranosyloxy)dodecahydro-4′b,8′,8′,10′a-tetramethyl-,(1′S,2′R,4′aR,4′bR,7′S,8′aR,10′aR)-;21-Nor-16,17-secodammarane-16,26-dioic acid,20-(acetyloxy)-3-(β-D-glucopyranosyloxy)-23,30-dihydroxy-17-methyl-,di-γ-lactone,(3β,17R,20S,23S,25R)-;(1′S,2′R,4′aR,4′bR,7′S,8′aR,10′aR)-2′-[(1R,2S)-2-(Acetyloxy)-1-methyl-3-[(2S,4R)-tetrahydro-4-methyl-5-oxo-2-furanyl]propyl]-7′-(β-D-glucopyranosyloxy)dodecahydro-4′b,8′,8′,10′a-tetramethylspiro[furan-3(2H),1′(2′H)-phenanthren]-5(4H)-one;Hovenidulcioside B2
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CAS No:
21-Nor-16,17-secodammarane-16,26-dioic acid,20-(acetyloxy)-3-(β-D-glucopyranosyloxy)-23,30-dihydroxy-17-methyl-,di-γ-lactone,(3β,17R,20S,23S,25R)- Basic Attributes
708.87600
708.88
DTXSID70169911
Computed Properties
Molecular Weight:708.9
XLogP3:4.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:708.40847734
Monoisotopic Mass:708.40847734
Topological Polar Surface Area:178
Heavy Atom Count:50
Complexity:1300
Defined Atom Stereocenter Count:16
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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