Oscillaginin B
AlkaPlorer ID: AK002719
Synonym: None
IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-3-amino-2-hydroxydecanoyl]amino]-3-hydroxypropanoyl]-methylamino]-3-methylbutanoyl]amino]-4-(4-hydroxyphenyl)butanoic acid
Structure
SMILES: CCCCCCC[C@@H](N)[C@H](O)C(O)=N[C@@H](CO)C(=O)N(C)[C@H](C(O)=N[C@@H](CCC1=CC=C(O)C=C1)C(=O)O)C(C)C
InChI: InChI=1S/C29H48N4O8/c1-5-6-7-8-9-10-21(30)25(36)27(38)32-23(17-34)28(39)33(4)24(18(2)3)26(37)31-22(29(40)41)16-13-19-11-14-20(35)15-12-19/h11-12,14-15,18,21-25,34-36H,5-10,13,16-17,30H2,1-4H3,(H,31,37)(H,32,38)(H,40,41)/t21-,22+,23+,24+,25+/m1/s1
InChIKey: FAFNVISAZDFOJC-RYWAYVEBSA-N
Reference
A 3-amino-10-chloro-2-hydroxydecanoic acid-containing tetrapeptide from Oscillatoria agardhii
PubChem CID: 44825956
LOTUS: LTS0252632
SuperNatural Ⅲ: SN0080273-01
NPASS: NPC246802
{NPAtlas: NPA019690
Source
Properties Information
Molecule Weight: 580.7230000000003
TPSA？: 209.5
MolLogP？: 2.5836000000000032
Number of H-Donors: 7
Number of H-Acceptors: 8
RingCount: 1
Activities Information
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