[(1R,4S,5R,7S,8S,12R,15S,16R,18S,19S)-19-acetyloxy-2,13-dioxo-6,17-dioxa-23,24-dithia-3,14-diazaoctacyclo[10.10.2.01,14.03,12.04,10.05,7.015,21.016,18]tetracosa-9,20-dien-8-yl] butanoate
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[(1R,4S,5R,7S,8S,12R,15S,16R,18S,19S)-19-acetyloxy-2,13-dioxo-6,17-dioxa-23,24-dithia-3,14-diazaoctacyclo[10.10.2.01,14.03,12.04,10.05,7.015,21.016,18]tetracosa-9,20-dien-8-yl] butanoate
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CAS No:
220345-71-1
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Formula:
C24H24N2O8S2
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Chemical Name:
[(1R,4S,5R,7S,8S,12R,15S,16R,18S,19S)-19-acetyloxy-2,13-dioxo-6,17-dioxa-23,24-dithia-3,14-diazaoctacyclo[10.10.2.01,14.03,12.04,10.05,7.015,21.016,18]tetracosa-9,20-dien-8-yl] butanoate
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Synonyms:
Ambewelamide A;220345-71-1;Scabrosin B;NSC712399;CHEMBL1966331;DTXSID10328005;NSC-712399;NCI60_039333;Butanoic acid,2S,4aR,6aS,6bR,7aS,8S,10aR,12aS,12bR)- 8-(acetyloxy)-1a,2,6a,6b,7a,8,12a,12b-octahydro- 5,11-dioxo-5H,11H-4a,10a-epidithio-4H,10H-bisoxireno[g,g'] pyrazino[1,2-a:4,5-a']diindol-2-yl ester
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CAS No:
[(1R,4S,5R,7S,8S,12R,15S,16R,18S,19S)-19-acetyloxy-2,13-dioxo-6,17-dioxa-23,24-dithia-3,14-diazaoctacyclo[10.10.2.01,14.03,12.04,10.05,7.015,21.016,18]tetracosa-9,20-dien-8-yl] butanoate Basic Attributes
532.6 g/mol
532.09740808 g/mol
712399
DTXSID10328005
Computed Properties
Molecular Weight:532.6
XLogP3:-0.7
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:532.09740808
Monoisotopic Mass:532.09740808
Topological Polar Surface Area:169
Heavy Atom Count:36
Complexity:1220
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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