Neochinulin A
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Neochinulin A
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CAS No:
51551-29-2
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Formula:
C19H21N3O2
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Chemical Name:
Neochinulin A
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Synonyms:
(3S)-3α-Methyl-6-[(Z)-[2-(1,1-dimethyl-2-propenyl)-1H-indole-3-yl]methylene]hexahydropyrazine-2,5-dione;(6S)-3-[(Z)-[2-(1,1-Dimethyl-2-propenyl)-1H-indol-3-yl]methylene]-6-methyl-2,5-piperazinedione;Neochinulin A;Neoechinulin A
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CAS No:
Characteristics
73.99000
3.26450
1?+-.0.06 g/cm3(Predicted)
272-275 °C
655.727ºC at 760 mmHg
350.371ºC
Computed Properties
Molecular Weight:323.4
XLogP3:3.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:323.16337692
Monoisotopic Mass:323.16337692
Topological Polar Surface Area:74
Heavy Atom Count:24
Complexity:581
Defined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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