(22S)-4,5,10-trimethoxy-18-azahexacyclo[12.11.0.02,7.08,13.016,24.018,22]pentacosa-1(14),2,4,6,8(13),9,11,16(24)-octaene
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![(22S)-4,5,10-trimethoxy-18-azahexacyclo[12.11.0.02,7.08,13.016,24.018,22]pentacosa-1(14),2,4,6,8(13),9,11,16(24)-octaene structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b2dbfd98283e4ea98ed588625f616487.png "(22S)-4,5,10-trimethoxy-18-azahexacyclo[12.11.0.02,7.08,13.016,24.018,22]pentacosa-1(14),2,4,6,8(13),9,11,16(24)-octaene")
(22S)-4,5,10-trimethoxy-18-azahexacyclo[12.11.0.02,7.08,13.016,24.018,22]pentacosa-1(14),2,4,6,8(13),9,11,16(24)-octaene
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CAS No:
97387-93-4
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Formula:
C27H29NO3
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Chemical Name:
(22S)-4,5,10-trimethoxy-18-azahexacyclo[12.11.0.02,7.08,13.016,24.018,22]pentacosa-1(14),2,4,6,8(13),9,11,16(24)-octaene
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Synonyms:
hypoestestatin 1;Hypoestestatin 1;97387-93-4;(S)-9,10,12,13,14,14a,15,16-Octahydro-2,3,6-trimethoxyphenanthro(9,10-g)pyrrolo(1,2-b)isoquinoline;DTXSID00913949;Phenanthro(9,10-g)pyrrolo(1,2-b)isoquinoline, 9,10,12,13,14,14a,15,16-octahydro-2,3,6-trimethoxy-, (S)-;2,3,6-Trimethoxy-9,10,12,13,14,14a,15,16-octahydrophenanthro[9,10-g]pyrrolo[1,2-b]isoquinoline
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CAS No:
(22S)-4,5,10-trimethoxy-18-azahexacyclo[12.11.0.02,7.08,13.016,24.018,22]pentacosa-1(14),2,4,6,8(13),9,11,16(24)-octaene Basic Attributes
415.5 g/mol
415.21474379 g/mol
Computed Properties
Molecular Weight:415.5
XLogP3:4.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:415.21474379
Monoisotopic Mass:415.21474379
Topological Polar Surface Area:30.9
Heavy Atom Count:31
Complexity:707
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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