(Q82124453)

English

Dimethyl (2S,2'S)-2,2'-[1,3-phenylenebis(carbonylazanediyl)]bis[3-(1H-indol-3-yl)propanoate] (non-preferred name)

chemical compound

In more languages

Statements

type of chemical entity

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tryptamine alkaloid

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based on heuristic

inferred from SMILES

566.2165346800001 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₂H₃₀N₄O₆

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canonical SMILES

COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c1cccc(C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)OC)c1

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=CC(=CC=C3)C(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)OC

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Identifiers

InChI=1S/C32H30N4O6/c1-41-31(39)27(15-21-17-33-25-12-5-3-10-23(21)25)35-29(37)19-8-7-9-20(14-19)30(38)36-28(32(40)42-2)16-22-18-34-26-13-6-4-11-24(22)26/h3-14,17-18,27-28,33-34H,15-16H2,1-2H3,(H,35,37)(H,36,38)/t27-,28-/m0/s1

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UHRUVWDYBASIFT-NSOVKSMOSA-N

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CAS Registry Number

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1 reference

matched by identifier from

UHRUVWDYBASIFT-NSOVKSMOSA-N

UniChem compound ID

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DSSTox substance ID

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matched by identifier from

UHRUVWDYBASIFT-NSOVKSMOSA-N

DSSTOX compound identifier

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