[13-acetyloxy-1,5,6-trihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] tetradecanoate
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![[13-acetyloxy-1,5,6-trihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] tetradecanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/72ead17730fb4ddb99a449c29794b105.png "[13-acetyloxy-1,5,6-trihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] tetradecanoate")
[13-acetyloxy-1,5,6-trihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] tetradecanoate
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CAS No:
56937-68-9
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Formula:
C36H58O8
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Chemical Name:
[13-acetyloxy-1,5,6-trihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] tetradecanoate
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Synonyms:
phorbolol myristate acetate;phorbolol-12-myristate-13-acetate;Phorbolol myristate acetate;56937-68-9;TPA-3-beta-ol;Phorbolol acetate myristate;NSC 278618;NSC278618;phorbolol-12-myristate-13-acetate;DTXSID00972379;NSC-278618;5H-Cyclopropa(3,4)benz(1,2-e)azulen-5-ol, 1,1a-beta,1b-alpha,4,4a,7a-beta,7b,8,9,9a-decahydro-4a-alpha,7b-beta,9-alpha,9a-beta-tetrahydroxy-3-(hydroxymethyl)-1,1,6,8-beta-tetramethyl-, 9a-acetate 9-myristate;9a-(acetyloxy)-4a,5,7b-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl tetradecanoate
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CAS No:
[13-acetyloxy-1,5,6-trihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] tetradecanoate Basic Attributes
618.8 g/mol
618.41316880 g/mol
278618
Computed Properties
Molecular Weight:618.8
XLogP3:5.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:17
Exact Mass:618.41316880
Monoisotopic Mass:618.41316880
Topological Polar Surface Area:134
Heavy Atom Count:44
Complexity:1110
Undefined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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