1-[(4R,12S,13R,14S,18R,20S)-8,14-dimethoxy-15-oxa-1,11-diazahexacyclo[15.3.1.0⁴,¹².0⁴,²⁰.0⁵,¹⁰.0¹³,¹⁸]henicosa-5(10),6,8,16-tetraen-11-yl]ethanone

AlkaPlorer ID: AK266592

Synonym: None

IUPAC Name: 1-[(4R,12S,13R,14S,18R,20S)-8,14-dimethoxy-15-oxa-1,11-diazahexacyclo[15.3.1.04,12.04,20.05,10.013,18]henicosa-5(10),6,8,16-tetraen-11-yl]ethanone

Structure

SMILES: COC1=CC=C2C(=C1)N(C(C)=O)[C@H]1[C@@H]3[C@@H](OC)OC=C4CN5CC[C@]21[C@@H]5C[C@@H]43

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InChI: InChI=1S/C22H26N2O4/c1-12(25)24-17-8-14(26-2)4-5-16(17)22-6-7-23-10-13-11-28-21(27-3)19(20(22)24)15(13)9-18(22)23/h4-5,8,11,15,18-21H,6-7,9-10H2,1-3H3/t15-,18-,19+,20-,21-,22+/m0/s1

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InChIKey: KISKJMKSADKAMN-XEEILAJESA-N

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Source

Properties Information

Molecule Weight: 382.4600000000002

TPSA: 51.24

MolLogP: 2.2787000000000006

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information