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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012724

17-(16,24-Dihydroxy-5-methoxy-14-oxapentacyclo[20.2.2.210,13.115,19.02,7]nonacosa-1(24),2(7),3,5,10(29),11,13(28),15(27),16,18,22,25-dodecaen-17-yl)-5-methoxy-14-oxapentacyclo[20.2.2.210,13.115,19.02,7]nonacosa-1(24),2(7),3,5,10(29),11,13(28),15(27),16,18,22,25-dodecaene-16,24-diol

Formula: C58H50O8  |  Mol. Weight: 875.00 g/mol

IUPAC: 17-(16,24-dihydroxy-5-methoxy-14-oxapentacyclo[20.2.2.210,13.115,19.02,7]nonacosa-1(24),2(7),3,5,10(29),11,13(28),15(27),16,18,22,25-dodecaen-17-yl)-5-methoxy-14-oxapentacyclo[20.2.2.210,13.115,19.02,7]nonacosa-1(24),2(7),3,5,10(29),11,13(28),15(27),16,18,22,25-dodecaene-16,24-diol

Overview

Molecular Formula C58H50O8
Molecular Weight 875.00 g/mol
Canonical SMILES COC1=CC2=C(C=C1)C3=C(C=C(CCC4=CC(=C(C(=C4)OC5=CC=C(CC2)C=C5)O)C6=C(C7=CC(=C6)CCC8=CC(=C(C=C8)C9=C(CCC1=CC=C(O7)C=C1)C=C(C=C9)OC)O)O)C=C3)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy