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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009823

(2S)-5-(diaminomethylideneamino)-2-[[4-[[(1R,2S,4R,6R,7R,10S,11S,14S,16R)-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl]oxy]-4-oxobutanoyl]amino]pentanoic acid

Formula: C34H48N4O8  |  Mol. Weight: 640.80 g/mol

IUPAC: (2S)-5-(diaminomethylideneamino)-2-[[4-[[(1R,2S,4R,6R,7R,10S,11S,14S,16R)-7,11-dimethyl-6-(6-oxopyran-3-yl)-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-14-yl]oxy]-4-oxobutanoyl]amino]pentanoic acid

Overview

Molecular Formula C34H48N4O8
Molecular Weight 640.80 g/mol
Canonical SMILES CC12CCC(CC1CCC3C2CCC4(C35C(O5)CC4C6=COC(=O)C=C6)C)OC(=O)CCC(=O)NC(CCCN=C(N)N)C(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy