Nostopeptin B
AlkaPlorer ID: AK001326
Synonym: '', 'Nostopeptin B'
IUPAC Name: (4S)-4-acetamido-5-[(1S,4S,7R,10R,11S,14R,17S,20S,22R)-14-[(2R)-butan-2-yl]-20-[(2S)-butan-2-yl]-22-hydroxy-17-[(4-hydroxyphenyl)methyl]-10,18-dimethyl-4-(2-methylpropyl)-3,6,13,16,19,25-hexaoxo-12-oxa-2,5,8,15,18,21-hexazatricyclo[19.3.1.07,11]pentacosan-8-yl]-5-oxopentanamide
Structure
SMILES: CC[C@@H](C)[C@H]1N=C(O)[C@H](CC2=CC=C(O)C=C2)N(C)C(=O)[C@H]([C@@H](C)CC)N2C(=O)[C@H](CC[C@H]2O)N=C(O)[C@H](CC(C)C)N=C(O)[C@H]2[C@@H](OC1=O)[C@H](C)CN2C(=O)[C@H](CCC(=N)O)N=C(C)O
InChI: InChI=1S/C46H70N8O12/c1-10-24(5)36-46(65)66-39-26(7)22-53(43(62)30(48-27(8)55)16-18-34(47)57)38(39)42(61)50-32(20-23(3)4)40(59)49-31-17-19-35(58)54(44(31)63)37(25(6)11-2)45(64)52(9)33(41(60)51-36)21-28-12-14-29(56)15-13-28/h12-15,23-26,30-33,35-39,56,58H,10-11,16-22H2,1-9H3,(H2,47,57)(H,48,55)(H,49,59)(H,50,61)(H,51,60)/t24-,25+,26-,30+,31+,32+,33+,35-,36-,37+,38-,39+/m1/s1
InChIKey: QMXYZAMGCKYKHQ-WNWHHKPNSA-N
Reference
Nostopeptins A and B, Elastase Inhibitors from the Cyanobacterium <i>Nostoc minutum</i>
PubChem CID: 163037980
LOTUS: LTS0085850
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nostoc minutum | Nostoc | Nostocaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 927.11
TPSA？: 302.13
MolLogP？: 4.617470000000007
Number of H-Donors: 8
Number of H-Acceptors: 12
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|