3-[3-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxydodecanoyloxy]decanoic acid
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![3-[3-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxydodecanoyloxy]decanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f17027d4b5164c239678e7c93d6fdc14.png "3-[3-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxydodecanoyloxy]decanoic acid")
3-[3-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxydodecanoyloxy]decanoic acid
structure -
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CAS No:
154886-56-3
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Formula:
C34H62O13
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Chemical Name:
3-[3-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxydodecanoyloxy]decanoic acid
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Synonyms:
UNII-LC4VF43NAF;LC4VF43NAF;RHA2 C12-C10;UNII-PB22NX2CJL component JMXIZPHMCSEVNY-QSFPOUSZSA-N;154886-56-3;Dodecanoic acid, 3-((6-deoxy-2-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-mannopyranosyl)oxy)-, 1-(carboxymethyl)octyl ester
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CAS No:
3-[3-[(2R,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxydodecanoyloxy]decanoic acid Basic Attributes
678.8 g/mol
678.41904203 g/mol
LC4VF43NAF
Computed Properties
Molecular Weight:678.8
XLogP3:4.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:24
Exact Mass:678.41904203
Monoisotopic Mass:678.41904203
Topological Polar Surface Area:202
Heavy Atom Count:47
Complexity:875
Defined Atom Stereocenter Count:10
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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