11-Methoxyvincadifformine

AlkaPlorer ID: AK035666

Synonym: '6,7-Dihydro-11-methoxytabersonine'

IUPAC Name: methyl (1S,12S,18S,19S)-12-ethyl-18-methoxy-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,9-tetraene-10-carboxylate

Structure

SMILES: CC[C@]12CCCN3C[C@@H](OC)[C@]4(C(=C(C(=O)OC)C1)NC1=CC=CC=C14)[C@@H]32

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InChI: InChI=1S/C22H28N2O3/c1-4-21-10-7-11-24-13-17(26-2)22(20(21)24)15-8-5-6-9-16(15)23-18(22)14(12-21)19(25)27-3/h5-6,8-9,17,20,23H,4,7,10-13H2,1-3H3/t17-,20+,21+,22-/m1/s1

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InChIKey: BPDKTQZPNORXPH-KDXIVRHGSA-N

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Source

Properties Information

Molecule Weight: 368.477

TPSA: 50.8

MolLogP: 3.070100000000001

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information