β-D-Glucopyranosiduronic acid, (3β)-18-(acetyloxy)-16-oxo-28-norolean-12-en-3-yl O-β-D-galactopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→4)]-
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![β-D-Glucopyranosiduronic acid, (3β)-18-(acetyloxy)-16-oxo-28-norolean-12-en-3-yl O-β-D-galactopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→4)]- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7f62ee9aa4d54ca8a3f08693cfe22ba8.png "β-D-Glucopyranosiduronic acid, (3β)-18-(acetyloxy)-16-oxo-28-norolean-12-en-3-yl O-β-D-galactopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→4)]-")
β-D-Glucopyranosiduronic acid, (3β)-18-(acetyloxy)-16-oxo-28-norolean-12-en-3-yl O-β-D-galactopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→4)]-
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CAS No:
96827-22-4
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Formula:
C55H86O25
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Chemical Name:
β-D-Glucopyranosiduronic acid, (3β)-18-(acetyloxy)-16-oxo-28-norolean-12-en-3-yl O-β-D-galactopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→4)]-
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Synonyms:
β-D-Glucopyranosiduronic acid,(3β)-18-(acetyloxy)-16-oxo-28-norolean-12-en-3-yl O-β-D-galactopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→4)]-;28-Noroleanane,β-D-glucopyranosiduronic acid deriv.;Camellidin I;Camellidin monoacetate;119253-75-7
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CAS No:
β-D-Glucopyranosiduronic acid, (3β)-18-(acetyloxy)-16-oxo-28-norolean-12-en-3-yl O-β-D-galactopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→4)]- Basic Attributes
1147.3 g/mol
1147.26
Computed Properties
Molecular Weight:1147.3
XLogP3:-0.4
Hydrogen Bond Donor Count:13
Hydrogen Bond Acceptor Count:25
Rotatable Bond Count:14
Exact Mass:1146.54581822
Monoisotopic Mass:1146.54581822
Topological Polar Surface Area:397
Heavy Atom Count:80
Complexity:2300
Defined Atom Stereocenter Count:28
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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