2-[(3S,6R,9S,15S,18S,21S,24S)-21-benzyl-15-(2-methylpropyl)-2,5,8,14,17,20,23-heptaoxo-6,18-di(propan-2-yl)-1,4,7,13,16,19,22-heptazatricyclo[22.3.0.09,13]heptacosan-3-yl]acetamide
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2-[(3S,6R,9S,15S,18S,21S,24S)-21-benzyl-15-(2-methylpropyl)-2,5,8,14,17,20,23-heptaoxo-6,18-di(propan-2-yl)-1,4,7,13,16,19,22-heptazatricyclo[22.3.0.09,13]heptacosan-3-yl]acetamide
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CAS No:
153723-34-3
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Formula:
C39H58N8O8
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Chemical Name:
2-[(3S,6R,9S,15S,18S,21S,24S)-21-benzyl-15-(2-methylpropyl)-2,5,8,14,17,20,23-heptaoxo-6,18-di(propan-2-yl)-1,4,7,13,16,19,22-heptazatricyclo[22.3.0.09,13]heptacosan-3-yl]acetamide
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Synonyms:
axinastatin 2;cyclo(Pro-Val-Asn-Pro-Phe-Val-Leu);Axinastatin 2;153723-34-3;Cyclo(pro-val-asn-pro-phe-val-leu);Axinastatin 1, 5-L-leucine-;DTXSID80934798;2-[12-Benzyl-8,11,14,22,25-pentahydroxy-6-(2-methylpropyl)-5,19-dioxo-9,23-di(propan-2-yl)-2,3,5,6,9,12,14a,15,16,17,19,20,23,25a-tetradecahydro-1H-dipyrrolo[1,2-a:1',2'-j][1,4,7,10,13,16,19]heptaazac
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CAS No:
2-[(3S,6R,9S,15S,18S,21S,24S)-21-benzyl-15-(2-methylpropyl)-2,5,8,14,17,20,23-heptaoxo-6,18-di(propan-2-yl)-1,4,7,13,16,19,22-heptazatricyclo[22.3.0.09,13]heptacosan-3-yl]acetamide Basic Attributes
766.9 g/mol
766.43776084 g/mol
Computed Properties
Molecular Weight:766.9
XLogP3:2.2
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:766.43776084
Monoisotopic Mass:766.43776084
Topological Polar Surface Area:229
Heavy Atom Count:55
Complexity:1450
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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