3-[[4-formamido-3,5,6,8-tetrahydroxy-4-(hydroxymethyl)-7-methylidene-5,6,8-tris(2-oxoethyl)pyrrolo[1,2-a]indol-2-yl]amino]but-3-enoic acid
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![3-[[4-formamido-3,5,6,8-tetrahydroxy-4-(hydroxymethyl)-7-methylidene-5,6,8-tris(2-oxoethyl)pyrrolo[1,2-a]indol-2-yl]amino]but-3-enoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/97cb5d13efe846babbddc2ff5ad8cfc1.png "3-[[4-formamido-3,5,6,8-tetrahydroxy-4-(hydroxymethyl)-7-methylidene-5,6,8-tris(2-oxoethyl)pyrrolo[1,2-a]indol-2-yl]amino]but-3-enoic acid")
3-[[4-formamido-3,5,6,8-tetrahydroxy-4-(hydroxymethyl)-7-methylidene-5,6,8-tris(2-oxoethyl)pyrrolo[1,2-a]indol-2-yl]amino]but-3-enoic acid
structure -
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CAS No:
19269-59-1
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Formula:
C24H27N3O11
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Chemical Name:
3-[[4-formamido-3,5,6,8-tetrahydroxy-4-(hydroxymethyl)-7-methylidene-5,6,8-tris(2-oxoethyl)pyrrolo[1,2-a]indol-2-yl]amino]but-3-enoic acid
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Synonyms:
19269-59-1;DTXSID40940931;Acetamide, N-(2,3-dihydro-9-(hydroxymethyl)-6-methyl-1,5,7,8-tetrahydroxy-1H-pyrrolo(1,2-a)indol-2-yl)-, 1,5,7,8-tetraacetate 9-carbamate;3-{[1,5,7,8-Tetrahydroxy-9-(hydroxymethyl)-9-[(hydroxymethylidene)amino]-6-methylidene-5,7,8-tris(2-oxoethyl)-5,7,8,9-tetrahydro-6H-pyrrolo[1,2-a]indol-2-yl]amino}but-3-enoic acid
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CAS No:
3-[[4-formamido-3,5,6,8-tetrahydroxy-4-(hydroxymethyl)-7-methylidene-5,6,8-tris(2-oxoethyl)pyrrolo[1,2-a]indol-2-yl]amino]but-3-enoic acid Basic Attributes
533.5 g/mol
533.16455869 g/mol
Computed Properties
Molecular Weight:533.5
XLogP3:-4
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:12
Exact Mass:533.16455869
Monoisotopic Mass:533.16455869
Topological Polar Surface Area:236
Heavy Atom Count:38
Complexity:1110
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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