Anopterimine

AlkaPlorer ID: AK145111

Synonym: ''

IUPAC Name: [(1S,4R,5R,9S,12S,13R,14S,15S,16S,17S)-16-hydroxy-9-methyl-19-methylidene-11-azahexacyclo[12.3.2.01,13.04,9.05,12.05,17]nonadec-10-en-15-yl] (E)-2-methylbut-2-enoate

Structure

SMILES: C=C1C[C@@]23CC[C@@H]4[C@@]56CCC[C@]4(C)C=N[C@H]5[C@@H]2[C@@H]1[C@H](OC(=O)/C(C)=C/C)[C@@H](O)[C@@H]36

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InChI: InChI=1S/C25H33NO3/c1-5-13(2)22(28)29-19-16-14(3)11-24-10-7-15-23(4)8-6-9-25(15,20(24)18(19)27)21(17(16)24)26-12-23/h5,12,15-21,27H,3,6-11H2,1-2,4H3/b13-5+/t15-,16+,17-,18+,19-,20-,21-,23+,24-,25+/m0/s1

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InChIKey: VHNBBQRITVSNFR-MHQLHRBPSA-N

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Source

Properties Information

Molecule Weight: 395.5430000000001

TPSA: 58.89

MolLogP: 4.087000000000003

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information