(Q82987574)

English

6-Amino-8a-methoxy-5-methyl-8-methylidene-1,1a,2,8,8a,8b-hexahydroazireno[2',3':3,4]pyrrolo[1,2-a]indole-4,7-dione

chemical compound

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Statements

type of chemical entity

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chemical compound

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273.11134134 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₁₄H₁₅N₃O₃

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canonical SMILES

C=C1C2=C(C(=O)C(C)=C(N)C2=O)N2CC3NC3C12OC

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

CC1=C(C(=O)C2=C(C1=O)N3C[C@@H]4[C@H]([C@@]3(C2=C)OC)N4)N

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Identifiers

InChI=1S/C14H15N3O3/c1-5-9(15)12(19)8-6(2)14(20-3)13-7(16-13)4-17(14)10(8)11(5)18/h7,13,16H,2,4,15H2,1,3H3/t7-,13-,14-/m1/s1

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NZNFISCGOZNYBD-HGDANNRKSA-N

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CAS Registry Number

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matched by identifier from

NZNFISCGOZNYBD-HGDANNRKSA-N

UniChem compound ID

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DSSTox substance ID

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matched by identifier from

NZNFISCGOZNYBD-HGDANNRKSA-N

DSSTOX compound identifier

DTXCID701422971

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