Amphibine E

AlkaPlorer ID: AK066384

Synonym: None

IUPAC Name: N-[1-(10-butan-2-yl-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.2.2.03,7]nonadeca-1(17),13,15,18-tetraen-6-yl)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-(dimethylamino)-4-methylpentanamide

Structure

SMILES: CCC(C)C1N=C(O)C2C(CCN2C(=O)C(CC2=CNC3=CC=CC=C23)N=C(O)C(CC(C)C)N(C)C)OC2=CC=C(C=CN=C1O)C=C2

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InChI: InChI=1S/C38H50N6O5/c1-7-24(4)33-36(46)39-18-16-25-12-14-27(15-13-25)49-32-17-19-44(34(32)37(47)42-33)38(48)30(41-35(45)31(43(5)6)20-23(2)3)21-26-22-40-29-11-9-8-10-28(26)29/h8-16,18,22-24,30-34,40H,7,17,19-21H2,1-6H3,(H,39,46)(H,41,45)(H,42,47)

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InChIKey: GAIJJGBWWFCJPU-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 670.8550000000001

TPSA: 146.34

MolLogP: 6.372300000000005

Number of H-Donors: 4

Number of H-Acceptors: 6

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information