(Q82247820)

English

K252b

chemical compound

9,12-Epoxy-1H-diindolo[1,2,3-fg:3',2',1'-kl]pyrrolo[3,4-i][1,6]benzodiazocine-10-carboxylicacid, 2,3,9,10,11,12-hexahydro-10-hydroxy-9-methyl-1-oxo-, (9S,10R,12R)-

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Statements

type of chemical entity

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indolo[2,3-a]carbazole alkaloid

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chemical structure

K252b.svg
565 × 655; 26 KB

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453.132470708 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₆H₁₉N₃O₅

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canonical SMILES

CC12OC(CC1(O)C(=O)O)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)CNC4=O

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isomeric SMILES

C[C@]12O[C@H](C[C@]1(O)C(=O)O)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)CNC4=O

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1 reference

The structures of the novel protein kinase C inhibitors K-252a, b, c and d

Identifiers

InChI=1S/C26H19N3O5/c1-25-26(33,24(31)32)10-17(34-25)28-15-8-4-2-6-12(15)19-20-14(11-27-23(20)30)18-13-7-3-5-9-16(13)29(25)22(18)21(19)28/h2-9,17,33H,10-11H2,1H3,(H,27,30)(H,31,32)/t17-,25+,26+/m1/s1

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AMSOPBXQXSAAAC-PLZPTFKGSA-N

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CAS Registry Number

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26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

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Natural Product Atlas ID

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based on heuristic

inferred from InChIKey

Probes And Drugs ID

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Sitelinks

Wikipedia(1 entry)

enwiki K252b

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