[(1R,2S,6R,10S,11R,13S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] hexadecanoate
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![[(1R,2S,6R,10S,11R,13S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] hexadecanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9d5a8af87ee6435382a04a97833c275c.png "[(1R,2S,6R,10S,11R,13S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] hexadecanoate")
[(1R,2S,6R,10S,11R,13S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] hexadecanoate
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CAS No:
66583-59-3
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Formula:
C36H58O6
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Chemical Name:
[(1R,2S,6R,10S,11R,13S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] hexadecanoate
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Synonyms:
12-deoxyphorbol 13-palmitate;12-Deoxyphorbol 13-palmitate;12-deoxyphorbol-13-hexadecanoate;66583-59-3;Baliospermum axillare;CHEBI:69820;DTXSID30314208;NSC281268;ZINC72320295;NSC-281268;Q27138161;PHORBOL,12-DEOXY- 13-PALMITATE B807430K057
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CAS No:
[(1R,2S,6R,10S,11R,13S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] hexadecanoate Basic Attributes
586.8 g/mol
586.42333957 g/mol
281268
DTXSID30314208
Computed Properties
Molecular Weight:586.8
XLogP3:8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:17
Exact Mass:586.42333957
Monoisotopic Mass:586.42333957
Topological Polar Surface Area:104
Heavy Atom Count:42
Complexity:1040
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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