About: [(1S,2S,5S,10S,11S,12R,13S,14S,15R,16R)-7-ethyl-2,11,12,14-tetrahydroxy-5-methyl-7-azahexacyclo[7.6.2.2¹⁰,¹³.0¹,⁸.0⁵,¹⁶.0¹⁰,¹⁵]nonadecan-12-yl]methyl benzoate

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About: [(1S,2S,5S,10S,11S,12R,13S,14S,15R,16R)-7-ethyl-2,11,12,14-tetrahydroxy-5-methyl-7-azahexacyclo[7.6.2.2¹⁰,¹³.0¹,⁸.0⁵,¹⁶.0¹⁰,¹⁵]nonadecan-12-yl]methyl benzoate Goto Sponge NotDistinct Permalink

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group of stereoisomers with the chemical formula C₂₉H₃₉NO₆

Attributes	Values
rdf:type	Item
description	groep van stereo-isomeren (nl) група стереоізомерів з хімічною формулою C₂₉H₃₉NO₆ (uk) group of stereoisomers with the chemical formula C₂₉H₃₉NO₆ (en)
rdfs:label	[(1S,2S,5S,10S,11S,12R,13S,14S,15R,16R)-7-ethyl-2,11,12,14-tetrahydroxy-5-methyl-7-azahexacyclo[7.6.2.2¹⁰,¹³.0¹,⁸.0⁵,¹⁶.0¹⁰,¹⁵]nonadecan-12-yl]methyl benzoate (en)
skos:prefLabel	[(1S,2S,5S,10S,11S,12R,13S,14S,15R,16R)-7-ethyl-2,11,12,14-tetrahydroxy-5-methyl-7-azahexacyclo[7.6.2.2¹⁰,¹³.0¹,⁸.0⁵,¹⁶.0¹⁰,¹⁵]nonadecan-12-yl]methyl benzoate (en)
name	[(1S,2S,5S,10S,11S,12R,13S,14S,15R,16R)-7-ethyl-2,11,12,14-tetrahydroxy-5-methyl-7-azahexacyclo[7.6.2.2¹⁰,¹³.0¹,⁸.0⁵,¹⁶.0¹⁰,¹⁵]nonadecan-12-yl]methyl benzoate (en)
isomeric SMILES	wds:Q105003741-AD4FA6E6-1859-4D9F-BB21-2624497EC0CD
isomeric SMILES	CCN1C[C@@]2(C)CC[C@H](O)[C@@]34C1C(C[C@H]23)[C@@]12CC[C@@H]([C@@H](O)[C@H]14)[C@@](O)(COC(=O)c1ccccc1)[C@H]2O
instance of	wds:Q105003741-55F849DD-8064-46F3-9ED1-AA29E9A9FD69
instance of	group of stereoisomers
subclass of	wds:Q105003741-496BB393-FC1E-4B4D-91B5-25CCB0419274
subclass of	atidane / atisine / hetisan type alkaloid
canonical SMILES	wds:Q105003741-F613BF2D-C29E-4EB1-A3A6-2E3A3501654E
InChI	wds:Q105003741-719ACB51-7408-489F-8B5F-82D7478EA710
InChIKey	wds:Q105003741-F7686C7D-F030-468F-9197-5AECAFA8E79C
chemical formula	wds:Q105003741-F1DA0F19-C7B8-4751-989F-455F8BA674B7
canonical SMILES	O=C(OCC1(O)C(O)C23CCC1C(O)C2C45C(O)CCC6(C)CN(CC)C5C3CC64)C=7C=CC=CC7
InChI	InChI=1S/C29H39NO6/c1-3-30-14-26(2)11-10-20(31)29-19(26)13-18(23(29)30)27-12-9-17(21(32)22(27)29)28(35,25(27)34)15-36-24(33)16-7-5-4-6-8-16/h4-8,17-23,25,31-32,34-35H,3,9-15H2,1-2H3/t17-,18?,19+,20-,21+,22+,23?,25-,26+,27-,28-,29-/m0/s1
InChIKey	FWZJUUDKKDGBNL-RVIXADKISA-N
chemical formula	C₂₉H₃₉NO₆
mass	wds:Q105003741-759E21DC-BD78-4F07-BF75-D1B174139900
mass	497.2777379679999 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105003741
is subclass of of	[(1S,2S,5S,8R,9R,10S,11S,12R,13S,14S,15R,16R)-7-ethyl-2,11,12,14-tetrahydroxy-5-methyl-7-azahexacyclo[7.6.2.210,13.01,8.05,16.010,15]nonadecan-12-yl]methyl benzoate
is subclass of of	wds:Q105003740-822E7B56-BA53-48B0-8BF2-4A83D8633345

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