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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP011333

Segetalin A

Formula: C31H43N7O6  |  Mol. Weight: 609.70 g/mol

IUPAC: (3S,9S,12S,15S,18S)-12-(1H-indol-3-ylmethyl)-9-methyl-3,15-di(propan-2-yl)-1,4,7,10,13,16-hexazabicyclo[16.3.0]henicosane-2,5,8,11,14,17-hexone

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Overview

Molecular Formula C31H43N7O6
Molecular Weight 609.70 g/mol
Canonical SMILES CC1C(=O)NCC(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)NC(C(=O)N1)CC3=CNC4=CC=CC=C43)C(C)C)C(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy