(1S,14R,18S,19R)-23,24-dimethoxy-8,10-dioxa-2-azaheptacyclo[16.7.1.0²,¹⁴.0⁵,¹³.0⁷,¹¹.0¹⁴,¹⁹.0²⁰,²⁵]hexacosa-5(13),6,11,20(25),21,23-hexaen-16-one

AlkaPlorer ID: AK319137

Synonym: None

IUPAC Name: 23,24-dimethoxy-8,10-dioxa-2-azaheptacyclo[16.7.1.02,14.05,13.07,11.014,19.020,25]hexacosa-5,7(11),12,20(25),21,23-hexaen-16-one

Structure

SMILES: COC1=CC=C2C(=C1OC)C1CC3CC(=O)CC4(C5=C(C=C6OCOC6=C5)CCN14)C23

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InChI: InChI=1S/C25H25NO5/c1-28-19-4-3-16-22(24(19)29-2)18-8-14-7-15(27)11-25(23(14)16)17-10-21-20(30-12-31-21)9-13(17)5-6-26(18)25/h3-4,9-10,14,18,23H,5-8,11-12H2,1-2H3

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InChIKey: HOZLCJIRVSAQBD-UHFFFAOYSA-N

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Reference

PubChem CID: 630738

NPASS: NPC21231

COCONUT: CNP0310656.1

Source

Properties Information

Molecule Weight: 419.4770000000002

TPSA: 57.23000000000001

MolLogP: 3.707200000000003

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information