(1S,17R)-4,5,17-trimethoxy-11-azatetracyclo[9.7.0.0¹,¹⁴.0²,⁷]octadeca-2(7),3,5,13,15-pentaene

AlkaPlorer ID: AK076120

Synonym: None

IUPAC Name: (17S)-4,5,17-trimethoxy-11-azatetracyclo[9.7.0.01,14.02,7]octadeca-2,4,6,13,15-pentaene

Structure

SMILES: COC1=C(OC)C=C2C(=C1)CCCN1CC=C3C=C[C@@H](OC)CC321

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InChI: InChI=1S/C20H25NO3/c1-22-16-7-6-15-8-10-21-9-4-5-14-11-18(23-2)19(24-3)12-17(14)20(15,21)13-16/h6-8,11-12,16H,4-5,9-10,13H2,1-3H3/t16-,20?/m1/s1

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InChIKey: FCYJGRFDMUVIHS-QRIPLOBPSA-N

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Reference

PubChem CID: 5317384

NPASS: NPC136446

Properties Information

Molecule Weight: 327.42400000000004

TPSA: 30.930000000000003

MolLogP: 3.0622000000000016

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information