(16S,17R,18S)-18-amino-10,10,16,17-tetramethyl-6-propyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13)-tetraen-4-one
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(16S,17R,18S)-18-amino-10,10,16,17-tetramethyl-6-propyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13)-tetraen-4-one
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CAS No:
183791-92-6
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Formula:
C22H29NO4
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Chemical Name:
(16S,17R,18S)-18-amino-10,10,16,17-tetramethyl-6-propyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13)-tetraen-4-one
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Synonyms:
12-Amino-7,8-dihydrocalanolide B;NSC692286;183791-92-6;12-Aminocalanolide B;12-Amino-7,8-dihydro-;CHEMBL448418;DTXSID40171480;NSC-692286;2H,6H,10H-Benzo(1,2-b:3,4-b':5,6-b'')tripyran-2-one, 12-amino-7,8,11,12-tetrahydro-6,6,10,11-tetramethyl-4-propyl-, (10S-(10alpha,11beta,12beta))-;2H,6H,10H-Benzo[1,2-b:3,4-b':5,6-b'']tripyran-2-one, 12-amino-7,8,11,12-tetrahydro-6,6,10,11-tetramethyl-4-propyl-, [10S-(10.alpha.,11.beta.,12.beta.)]-
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CAS No:
(16S,17R,18S)-18-amino-10,10,16,17-tetramethyl-6-propyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13)-tetraen-4-one Basic Attributes
371.5 g/mol
371.20965841 g/mol
692286
DTXSID40171480
Computed Properties
Molecular Weight:371.5
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:371.20965841
Monoisotopic Mass:371.20965841
Topological Polar Surface Area:70.8
Heavy Atom Count:27
Complexity:630
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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