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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP001577

[(1S,2S,3R,4aR,5R,6S,8S,8aR)-5-[(5S)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-8-acetyloxy-8a-(acetyloxymethyl)-3-hydroxy-5,6-dimethylspiro[3,4,4a,6,7,8-hexahydro-2H-naphthalene-1,2'-oxirane]-2-yl] propanoate

Formula: C27H40O10  |  Mol. Weight: 524.60 g/mol

IUPAC: [(1S,2S,3R,4aR,5R,6S,8S,8aR)-5-[(5S)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-8-acetyloxy-8a-(acetyloxymethyl)-3-hydroxy-5,6-dimethylspiro[3,4,4a,6,7,8-hexahydro-2H-naphthalene-1,2'-oxirane]-2-yl] propanoate

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Overview

Molecular Formula C27H40O10
Molecular Weight 524.60 g/mol
Canonical SMILES CCC(=O)OC1C(CC2C(C(CC(C2(C13CO3)COC(=O)C)OC(=O)C)C)(C)C4CC5CCOC5O4)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy