Molecule

Spumigin G

AlkaPlorer ID: AK074956

Synonym: None

IUPAC Name: (2S,4S)-N-[5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[(2R)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propanoyl]amino]-4-phenylbutanoyl]-4-methylpyrrolidine-2-carboxamide

Structure

SMILES: C[C@H]1C[C@@H](C(O)=NC(C=O)CCCNC(=N)N)N(C(=O)[C@@H](CCC2=CC=CC=C2)N=C(O)[C@H](O)CC2=CC=C(O)C=C2)C1

InChI: InChI=1S/C31H42N6O6/c1-20-16-26(28(41)35-23(19-38)8-5-15-34-31(32)33)37(18-20)30(43)25(14-11-21-6-3-2-4-7-21)36-29(42)27(40)17-22-9-12-24(39)13-10-22/h2-4,6-7,9-10,12-13,19-20,23,25-27,39-40H,5,8,11,14-18H2,1H3,(H,35,41)(H,36,42)(H4,32,33,34)/t20-,23?,25+,26-,27+/m0/s1

InChIKey: YGAGCUYKOBGAQX-SYCDWYGJSA-N

Reference

The non‐ribosomal assembly and frequent occurrence of the protease inhibitors spumigins in the bloom‐forming cyanobacterium <i>Nodularia spumigena</i>

PubChem CID: 139588808

LOTUS: LTS0160181

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NPAtlas: NPA020369

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Cyanobacterium	Geminocystaceae	Chroococcales	Cyanophyceae	Cyanobacteriota	None	Bacteria

Properties Information

Molecule Weight: 594.7130000000003

TPSA？: 204.92

MolLogP？: 2.2777700000000047

Number of H-Donors: 7

Number of H-Acceptors: 7

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi