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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034825

(1S,14R)-10-(diethylaminomethyl)-20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8(34),9,11,18,20,22(33),24,26,31-dodecaen-9-ol

Formula: C42H51N3O6  |  Mol. Weight: 693.90 g/mol

IUPAC: (1S,14R)-10-(diethylaminomethyl)-20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8(34),9,11,18,20,22(33),24,26,31-dodecaen-9-ol

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Overview

Molecular Formula C42H51N3O6
Molecular Weight 693.90 g/mol
Canonical SMILES CCN(CC)CC1=C(C2=CC(=C1)CC3C4=C(C(=C(C=C4CCN3C)OC)OC)OC5=C(C=C6CCN(C(C6=C5)CC7=CC=C(O2)C=C7)C)OC)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy