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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013824

(5aS,6S,7R,9aS)-6-[2-[(3S,5aS,6R,9aS)-3-hydroxy-2,2,5a-trimethyl-7-methylidene-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl]ethyl]-7-hydroxy-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydrobenzo[b]oxepin-3-one

Formula: C30H50O5  |  Mol. Weight: 490.70 g/mol

IUPAC: (5aS,6S,7R,9aS)-6-[2-[(3S,5aS,6R,9aS)-3-hydroxy-2,2,5a-trimethyl-7-methylidene-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl]ethyl]-7-hydroxy-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydrobenzo[b]oxepin-3-one

Overview

Molecular Formula C30H50O5
Molecular Weight 490.70 g/mol
Canonical SMILES CC1(C(CCC2(C(O1)CCC(=C)C2CCC3C4(CCC(=O)C(OC4CCC3(C)O)(C)C)C)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy