(16R,17S,18S)-18-hydroxy-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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![(16R,17S,18S)-18-hydroxy-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 structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9db849e8dc9643c0ba8d4e5158984316.png "(16R,17S,18S)-18-hydroxy-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")
(16R,17S,18S)-18-hydroxy-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:
183904-53-2
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Formula:
C22H28O5
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Chemical Name:
(16R,17S,18S)-18-hydroxy-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:
DHCal A;dihydrocalanolide A;NSC 675451;Dihydrocalanolide A;(+)-Dihydrocalanolide A;NSC678323;183904-53-2;NSC-678323;NSC665160;Racemic mixture of dihydro Calanolide A;2H,6H,10H-Benzo(1,2-b:3,4-b':5,6-b'')tripyran-2-one, 7,8,11,12-tetrahydro-12-hydroxy-6,6,10,11-tetramethyl-4-propyl-, (10R,11S,12S)-;2H,6H,10H-Benzo[1,2-b:3,4-b':5,6-b'']tripyran-2-one, 7,8,11,12-tetrahydro-12-hydroxy-6,6,10,11-tetramethyl-4-propyl-, (10R,11S,12S)-;NSC 678323;(+)dihydrocalanolide a;(+)-DH-Calanolide A;(+/-)-Dihydrocalanolide A;CHEMBL344417;(+)-7,8-Dihydrocalanolide A;DTXSID50171517
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CAS No:
(16R,17S,18S)-18-hydroxy-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
372.5 g/mol
372.19367399 g/mol
678323
DTXSID50171517
Computed Properties
Molecular Weight:372.5
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:372.19367399
Monoisotopic Mass:372.19367399
Topological Polar Surface Area:65
Heavy Atom Count:27
Complexity:626
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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