(1S,14S,24R)-24-methoxy-13-methyl-5,7,19,21,25-pentaoxa-13-azahexacyclo[12.11.0.0²,¹⁰.0⁴,⁸.0¹⁵,²³.0¹⁸,²²]pentacosa-2,4(8),9,15,17,22-hexaene

AlkaPlorer ID: AK319422

Synonym: None

IUPAC Name: (14R,24S)-24-methoxy-13-methyl-5,7,19,21,25-pentaoxa-13-azahexacyclo[12.11.0.02,10.04,8.015,23.018,22]pentacosa-2,4(8),9,15(23),16,18(22)-hexaene

Structure

SMILES: CO[C@H]1OC2C3=CC4=C(C=C3CCN(C)[C@@H]2C2=CC=C3OCOC3=C21)OCO4

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InChI: InChI=1S/C21H21NO6/c1-22-6-5-11-7-15-16(26-9-25-15)8-13(11)19-18(22)12-3-4-14-20(27-10-24-14)17(12)21(23-2)28-19/h3-4,7-8,18-19,21H,5-6,9-10H2,1-2H3/t18-,19?,21+/m1/s1

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InChIKey: XRBIHOLQAKITPP-DRPMKMPGSA-N

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Reference

PubChem CID: 5318652

NPASS: NPC247684

Properties Information

Molecule Weight: 383.4000000000002

TPSA: 58.620000000000005

MolLogP: 3.089500000000001

Number of H-Donors: 0

Number of H-Acceptors: 7

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information