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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003362

(1S,2S,4S,5R)-2-[[(Z)-[(3aS,4S,5S,6aS)-4-hydroxy-4-(hydroxymethyl)-5-methyl-2-oxo-3a,5,6,6a-tetrahydrocyclopenta[b]furan-3-ylidene]methyl]amino]-1'-methoxy-8-propanoylspiro[6-oxabicyclo[3.2.2]non-8-ene-4,3'-indole]-2'-one

Formula: C29H34N2O8  |  Mol. Weight: 538.60 g/mol

IUPAC: (1S,2S,4S,5R)-2-[[(Z)-[(3aS,4S,5S,6aS)-4-hydroxy-4-(hydroxymethyl)-5-methyl-2-oxo-3a,5,6,6a-tetrahydrocyclopenta[b]furan-3-ylidene]methyl]amino]-1'-methoxy-8-propanoylspiro[6-oxabicyclo[3.2.2]non-8-ene-4,3'-indole]-2'-one

Overview

Molecular Formula C29H34N2O8
Molecular Weight 538.60 g/mol
Canonical SMILES CCC(=O)C1=CC2C3(CC(C1CO2)NC=C4C5C(CC(C5(CO)O)C)OC4=O)C6=CC=CC=C6N(C3=O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy