Catalytic Enantioselective Total Synthesis of Hypocrolide A.
Qiao, Chuang; Zhang, Wen; Han, Jing-Chun; Li, Chuang-Chuang; Organic letters 18 (2016) 4932–4935; doi:10.1021/acs.orglett.6b02414

data_1555762
_publ_section_title
;
 Catalytic Enantioselective Total Synthesis of Hypocrolide A.
;
_journal_issue                   19
_journal_name_full               'Organic letters'
_journal_page_first              4932
_journal_page_last               4935
_journal_paper_doi               10.1021/acs.orglett.6b02414
_journal_volume                  18
_journal_year                    2016
_chemical_formula_moiety         'C15 H24 O4'
_chemical_formula_sum            'C15 H24 O4'
_chemical_formula_weight         268.34
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_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
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Olex2 1.2
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scan:
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	           Slice: -89.0000 - 1.0000
	     Image width: 1.0000
	        Exp time: 12.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 180.0000
	             XTD: 45.2194
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scan:
	Number of images: 180
	           Slice: -180.0000 - 0.0000
	     Image width: 1.0000
	        Exp time: 12.0000
	   Rotation axis: Omega
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	             Chi: 30.0000
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	             XTD: 45.2194
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scan:
	Number of images: 180
	           Slice: -180.0000 - 0.0000
	     Image width: 1.0000
	        Exp time: 12.0000
	   Rotation axis: Omega
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scan:
	Number of images: 180
	           Slice: -180.0000 - 0.0000
	     Image width: 1.0000
	        Exp time: 12.0000
	   Rotation axis: Omega
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	             Phi: 0.0000
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	          2theta: -90.0943
scan:
	Number of images: 180
	           Slice: -180.0000 - 0.0000
	     Image width: 1.0000
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	   Rotation axis: Omega
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scan:
	Number of images: 180
	           Slice: -180.0000 - 0.0000
	     Image width: 1.0000
	        Exp time: 12.0000
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	Number of images: 180
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	   Rotation axis: Omega
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	           Slice: -180.0000 - -10.0000
	     Image width: 1.0000
	        Exp time: 12.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 30.0000
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	           Slice: -180.0000 - -21.0000
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	        Exp time: 12.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 54.0000
	             Phi: 180.0000
	             XTD: 45.2194
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	           Slice: -180.0000 - -45.0000
	     Image width: 1.0000
	        Exp time: 12.0000
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_diffrn_measurement_device
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AFC11 (Right): Eulerian 3 circle
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_diffrn_measurement_device_type  'Rigaku Saturn944+ (2x2 bin mode)'
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_diffrn_measurement_specimen_support Fiber
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_diffrn_source                   'Sealed Tube'
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_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.2000P)^2^] where P=(Fo^2^+2Fc^2^)/3'
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_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value 'None' was changed
to 'none' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/ACS/depositions/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_database_code               1555762
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All O(H) groups
2.a Ternary CH refined with riding coordinates:
 C6(H6), C7(H7), C10(H10), C13(H13)
2.b Secondary CH2 refined with riding coordinates:
 C9(H9A,H9B), C14(H14A,H14B), C15(H15A,H15B)
2.c Idealised Me refined as rotating group:
 C16(H16A,H16B,H16C), C17(H17A,H17B,H17C), C18(H18A,H18B,H18C), C19(H19A,H19B,
 H19C)
2.d Idealised tetrahedral OH refined as rotating group:
 O3(H3), O4(H4)
;
_shelx_res_checksum              50102
_shelx_hkl_checksum              15261
_shelx_shelxl_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'