Aureoverticillactam

AlkaPlorer ID: AK023018

Synonym: '', 'Aureoverticillactam'

IUPAC Name: (3E,5E,7E,9S,10R,12S,13Z,15E,17E,19E,22S)-22-[(E)-hex-2-enyl]-9,10,12-trihydroxy-17-methyl-1-azacyclodocosa-3,5,7,13,15,17,19-heptaen-2-one

Structure

SMILES: CCC/C=C/C[C@H]1C/C=C/C=C(C)/C=C/C=C\[C@@H](O)C[C@@H](O)[C@@H](O)/C=C/C=C/C=C/C(O)=N1

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InChI: InChI=1S/C28H39NO4/c1-3-4-5-8-17-24-18-13-11-15-23(2)16-12-14-19-25(30)22-27(32)26(31)20-9-6-7-10-21-28(33)29-24/h5-16,19-21,24-27,30-32H,3-4,17-18,22H2,1-2H3,(H,29,33)/b7-6+,8-5+,13-11+,16-12+,19-14-,20-9+,21-10+,23-15+/t24-,25+,26-,27+/m0/s1

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InChIKey: VMKRIAILWBEBLR-LBCXWDQJSA-N

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Properties Information

Molecule Weight: 453.62300000000016

TPSA: 93.28

MolLogP: 5.217900000000007

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information