Paraherquamide H

AlkaPlorer ID: AK057258

Synonym: None

IUPAC Name: (1'S,6'S,7'R,8R,9'S)-4,4,6',10',10',13'-hexamethylspiro[10H-[1,4]dioxepino[2,3-g]indole-8,11'-3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane]-4',9,14'-trione

Structure

SMILES: C[C@H]1CC(=O)N2C[C@]34C[C@@]5(C(=O)NC6=C5C=CC5=C6OC=CC(C)(C)O5)C(C)(C)[C@@H]3C[C@]12C(=O)N4C

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InChI: InChI=1S/C28H33N3O5/c1-15-11-19(32)31-14-26-13-27(25(4,5)18(26)12-28(15,31)23(34)30(26)6)16-7-8-17-21(20(16)29-22(27)33)35-10-9-24(2,3)36-17/h7-10,15,18H,11-14H2,1-6H3,(H,29,33)/t15-,18-,26+,27+,28+/m0/s1

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InChIKey: SQFAENHNCOYHRZ-QPSLRDMESA-N

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Properties Information

Molecule Weight: 491.5880000000004

TPSA: 88.17999999999999

MolLogP: 3.207800000000001

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information