(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-2,3,3a,4,6a,9,10,13-Octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-1H-cyclotridec[d]isoindole-1,14,17-trione
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![(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-2,3,3a,4,6a,9,10,13-Octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-1H-cyclotridec[d]isoindole-1,14,17-trione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8bc304778f674f10bd4fc619b62f65f5.png "(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-2,3,3a,4,6a,9,10,13-Octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-1H-cyclotridec[d]isoindole-1,14,17-trione")
(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-2,3,3a,4,6a,9,10,13-Octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-1H-cyclotridec[d]isoindole-1,14,17-trione
structure -
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CAS No:
65745-47-3
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Formula:
C32H36N2O4
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Chemical Name:
(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-2,3,3a,4,6a,9,10,13-Octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-1H-cyclotridec[d]isoindole-1,14,17-trione
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Synonyms:
1H-Cyclotridec[d]isoindole-1,14,17-trione,2,3,3a,4,6a,9,10,13-octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-,(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-;[13]Cytochalasa-6,13,17,21-tetraene-1,20,23-trione,19-hydroxy-10-(1H-indol-3-yl)-16,18-dimethyl-,(13E,16S,17E,19R,21E)-;(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-2,3,3a,4,6a,9,10,13-Octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-1H-cyclotridec[d]isoindole-1,14,17-trione;Chaetoglobosin J;1H-Cyclotridec[d]isoindole-1,14,17-trione,2,3,3a,4,6a,9,10,13-octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-,[3S-(3R*,3aS*,4R*,6aR*,7E,10R*,11E,13S*,17aR*)]-
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CAS No:
(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-2,3,3a,4,6a,9,10,13-Octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-1H-cyclotridec[d]isoindole-1,14,17-trione Basic Attributes
512.6
512.64
Computed Properties
Molecular Weight:512.6
XLogP3:4.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:512.26750763
Monoisotopic Mass:512.26750763
Topological Polar Surface Area:99.3
Heavy Atom Count:38
Complexity:1100
Undefined Atom Stereocenter Count:7
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
(3S,3aR,4S,6aS,7E,10S,11E,13R,17aS)-2,3,3a,4,6a,9,10,13-Octahydro-13-hydroxy-3-(1H-indol-3-ylmethyl)-4,5,10,12-tetramethyl-1H-cyclotridec[d]isoindole-1,14,17-trione
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