1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, 3-ethoxy-8-(β-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-, methyl ester, (1S,3R,4aS,8S,8aS)-
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![1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, 3-ethoxy-8-(β-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-, methyl ester, (1S,3R,4aS,8S,8aS)- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2148faf722734c98b68ef56f99ec8198.png "1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, 3-ethoxy-8-(β-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-, methyl ester, (1S,3R,4aS,8S,8aS)-")
1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, 3-ethoxy-8-(β-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-, methyl ester, (1S,3R,4aS,8S,8aS)-
structure -
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CAS No:
945721-10-8
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Formula:
C19H30O11
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Chemical Name:
1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, 3-ethoxy-8-(β-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-, methyl ester, (1S,3R,4aS,8S,8aS)-
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Synonyms:
7-O-Ethylmorroniside;
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CAS No:
1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, 3-ethoxy-8-(β-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-, methyl ester, (1S,3R,4aS,8S,8aS)- Basic Attributes
434.43500
434.17881177
Computed Properties
Molecular Weight:434.4
XLogP3:-0.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:434.17881177
Monoisotopic Mass:434.17881177
Topological Polar Surface Area:153
Heavy Atom Count:30
Complexity:626
Undefined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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