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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034697

(2R,3R,4R,5R,6S)-2-[[(3S,6S,7S,8S,11R,12S,15R,16R)-3-hydroxy-15-[(2R,4R)-4-hydroxy-6-methyl-5-methylideneheptan-2-yl]-7,12,16-trimethyl-6-tetracyclo[9.7.0.03,8.012,16]octadec-1(18)-enyl]oxy]-6-methyloxane-3,4,5-triol

Formula: C36H60O7  |  Mol. Weight: 604.90 g/mol

IUPAC: (2R,3R,4R,5R,6S)-2-[[(3S,6S,7S,8S,11R,12S,15R,16R)-3-hydroxy-15-[(2R,4R)-4-hydroxy-6-methyl-5-methylideneheptan-2-yl]-7,12,16-trimethyl-6-tetracyclo[9.7.0.03,8.012,16]octadec-1(18)-enyl]oxy]-6-methyloxane-3,4,5-triol

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Overview

Molecular Formula C36H60O7
Molecular Weight 604.90 g/mol
Canonical SMILES CC1C2CCC3C(=CCC4(C3(CCC4C(C)CC(C(=C)C(C)C)O)C)C)CC2(CCC1OC5C(C(C(C(O5)C)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy