(7cis,9cis,11cis,13cis)-15-{[(1S)-1-Carboxy-3-methylbutyl]amino}r etinal
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![(7cis,9cis,11cis,13cis)-15-{[(1S)-1-Carboxy-3-methylbutyl]amino}r etinal structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/bdc12ce430434b138a2f4daad56a0e18.png "(7cis,9cis,11cis,13cis)-15-{[(1S)-1-Carboxy-3-methylbutyl]amino}r etinal")
(7cis,9cis,11cis,13cis)-15-{[(1S)-1-Carboxy-3-methylbutyl]amino}r etinal
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CAS No:
110683-02-8
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Formula:
C26H39NO3
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Chemical Name:
(7cis,9cis,11cis,13cis)-15-{[(1S)-1-Carboxy-3-methylbutyl]amino}r etinal
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Synonyms:
O-ethyl-N-(4-chloro-phenylcarbamimidoyl)-isourea; N-(Aethoxy-amino-methylen)-N'-(4-chlor-phenyl)-guanidin; N-(all-trans-retinoyl)-DL-leucine; O-Aethyl-N-(4-chlor-phenylcarbamimidoyl)-isoharnstoff; 2-[3,7-Dimethyl-9-(2,6,6-trimethyl-cyclohex-1-enyl)-nona-2,4,6,8-tetraenoylamino]-4-methyl-pentanoic acid;
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CAS No:
(7cis,9cis,11cis,13cis)-15-{[(1S)-1-Carboxy-3-methylbutyl]amino}r etinal Basic Attributes
413.59300
413.29299411
Computed Properties
Molecular Weight:413.6
XLogP3:7.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:413.29299411
Monoisotopic Mass:413.29299411
Topological Polar Surface Area:66.4
Heavy Atom Count:30
Complexity:776
Defined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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