Isohyperectine

AlkaPlorer ID: AK030331

Synonym: '', 'Hyperectine'

IUPAC Name: 3-amino-4-[(7R,8S)-6'-methylspiro[6,8-dihydrocyclopenta[g][1,3]benzodioxole-7,5'-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline]-8-yl]pyrrole-2,5-dione

Structure

SMILES: CN1CCC2=CC3=C(C=C2[C@]12CC1=CC=C4OCOC4=C1[C@H]2C1=C(N)C(=O)N=C1O)OCO3

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InChI: InChI=1S/C24H21N3O6/c1-27-5-4-11-6-15-16(32-9-31-15)7-13(11)24(27)8-12-2-3-14-21(33-10-30-14)17(12)19(24)18-20(25)23(29)26-22(18)28/h2-3,6-7,19H,4-5,8-10H2,1H3,(H3,25,26,28,29)/t19-,24-/m0/s1

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InChIKey: SPJFMVFHRMKUFD-CYFREDJKSA-N

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Source

Properties Information

Molecule Weight: 447.4470000000002

TPSA: 115.84

MolLogP: 1.8766

Number of H-Donors: 2

Number of H-Acceptors: 7

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information