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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP027009

(2Z)-2-[(2S,2'R,4'S,4aS,7S,7aR)-2-[(1Z)-2,6-dimethylhepta-1,5-dienyl]-4'-hydroxy-4-(hydroxymethyl)-2'-(3-hydroxypropyl)-4'-methylspiro[4a,5,6,7a-tetrahydro-2H-cyclopenta[b]pyran-7,3'-cyclohexane]-1'-ylidene]propanal

Formula: C30H46O5  |  Mol. Weight: 486.70 g/mol

IUPAC: (2Z)-2-[(2S,2'R,4'S,4aS,7S,7aR)-2-[(1Z)-2,6-dimethylhepta-1,5-dienyl]-4'-hydroxy-4-(hydroxymethyl)-2'-(3-hydroxypropyl)-4'-methylspiro[4a,5,6,7a-tetrahydro-2H-cyclopenta[b]pyran-7,3'-cyclohexane]-1'-ylidene]propanal

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Overview

Molecular Formula C30H46O5
Molecular Weight 486.70 g/mol
Canonical SMILES CC(=CCCC(=CC1C=C(C2CCC3(C2O1)C(C(=C(C)C=O)CCC3(C)O)CCCO)CO)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy