Subenniatin B

AlkaPlorer ID: AK082041

Synonym: None

IUPAC Name: (2S)-2-[[(2R)-2-[(2R)-2-[[(2R)-2-hydroxy-3-methylbutanoyl]-methylamino]-3-methylpentanoyl]oxy-3-methylbutanoyl]-methylamino]-3-methylbutanoic acid

Structure

SMILES: CCC(C)[C@H](C(=O)O[C@@H](C(=O)N(C)[C@H](C(=O)O)C(C)C)C(C)C)N(C)C(=O)[C@H](O)C(C)C

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InChI: InChI=1S/C23H42N2O7/c1-11-15(8)17(25(10)20(27)18(26)13(4)5)23(31)32-19(14(6)7)21(28)24(9)16(12(2)3)22(29)30/h12-19,26H,11H2,1-10H3,(H,29,30)/t15?,16-,17+,18+,19+/m0/s1

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InChIKey: VDOZOEVUMVAFKG-LHSROCTLSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Fusarium tricinctum Fusarium Nectriaceae Hypocreales Sordariomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 458.5960000000002

TPSA: 124.45

MolLogP: 2.011800000000001

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information