Rakicidin I

AlkaPlorer ID: AK144468

Synonym: None

IUPAC Name: 2-[(3S,14S,15S)-15-heptadecan-2-yl-7,14-dimethyl-11-methylidene-2,5,8,13-tetraoxo-1-oxa-4,7,12-triazacyclopentadec-9-en-3-yl]-2-hydroxyacetamide

Structure

SMILES: C=C1C=CC(=O)N(C)CC(O)=N[C@@H](C(O)C(=N)O)C(=O)O[C@@H](C(C)CCCCCCCCCCCCCCC)[C@H](C)C(O)=N1

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InChI: InChI=1S/C33H56N4O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(2)30-25(4)32(42)35-24(3)20-21-27(39)37(5)22-26(38)36-28(33(43)44-30)29(40)31(34)41/h20-21,23,25,28-30,40H,3,6-19,22H2,1-2,4-5H3,(H2,34,41)(H,35,42)(H,36,38)/t23?,25-,28-,29?,30-/m0/s1

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InChIKey: NLGSLKQAXDHJJO-IUTSIRGWSA-N

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Properties Information

Molecule Weight: 620.8320000000004

TPSA: 176.10000000000002

MolLogP: 6.371370000000006

Number of H-Donors: 5

Number of H-Acceptors: 7

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information