(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl) acetate
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(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl) acetate
structure -
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CAS No:
6159-99-5
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Formula:
C29H45NO3
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Chemical Name:
(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl) acetate
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Synonyms:
O-acetylsolasodine;spirosol-5-en-3-yl acetate;Acetylsolasodine;Solasodine, acetate (ester);MLS000736975;NSC96021;Spirosol-5-en-3-yl acetate;6159-99-5;Solasod-5-en-3.beta.-ol, acetate (ester);O-Acetylsolasodine;NSC-96021;Solasodine acetate;3-Acetyl-solasodine;Solasodine 3-acetate;Solasodine, 3-O-acetyl-;CHEMBL1390509;SCHEMBL14420713;Spirosol-5-en-3-yl acetate #;DTXSID60294382;HMS2271L04;Spirosol-5-en-3-ol, acetate (ester), (3.beta.,22.alpha.,25R)-;MCULE-2709801187;NCI60_042142;SMR000528449
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CAS No:
(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl) acetate Basic Attributes
455.7 g/mol
455.33994430 g/mol
96021
DTXSID60294382
Computed Properties
Molecular Weight:455.7
XLogP3:6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:455.33994430
Monoisotopic Mass:455.33994430
Topological Polar Surface Area:47.6
Heavy Atom Count:33
Complexity:854
Undefined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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