[(10Z)-4,9,13-tris(acetyloxy)-8-(benzoyloxy)-3,6,10,14-tetramethyl-2-oxo-16-oxatetracyclo[10.3.1.0¹,¹².0?,?]hexadec-10-en-6-yl]methyl pyridine-3-carboxylate

AlkaPlorer ID: AK267335

Synonym: None

IUPAC Name: (4,9,13-triacetyloxy-8-benzoyloxy-3,6,10,14-tetramethyl-2-oxo-16-oxatetracyclo[10.3.1.01,12.05,7]hexadec-10-en-6-yl)methyl pyridine-3-carboxylate

Structure

SMILES: CC(=O)OC1C(C)=CC23OC2(CC(C)C3OC(C)=O)C(=O)C(C)C(OC(C)=O)C2C(C1OC(=O)C1=CC=CC=C1)C2(C)COC(=O)C1=CC=CN=C1

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InChI: InChI=1S/C39H43NO12/c1-20-16-39-34(50-25(6)43)21(2)17-38(39,52-39)33(44)22(3)31(49-24(5)42)28-29(37(28,7)19-47-35(45)27-14-11-15-40-18-27)32(30(20)48-23(4)41)51-36(46)26-12-9-8-10-13-26/h8-16,18,21-22,28-32,34H,17,19H2,1-7H3

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InChIKey: ZUOLHGQLXMMZGR-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 717.7680000000001

TPSA: 173.99

MolLogP: 4.224100000000003

Number of H-Donors: 0

Number of H-Acceptors: 13

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information