Anchinopeptolide C
AlkaPlorer ID: AK021534
Synonym: ''
IUPAC Name: (2R,3S,4R)-3-[2-(diaminomethylideneamino)ethyl]-4-[3-(diaminomethylideneamino)propyl]-2,4-dihydroxy-1-[2-[[(E)-2-(4-hydroxyphenyl)ethenyl]amino]-2-oxoethyl]-N-[(2R)-1-[[(E)-2-(4-hydroxyphenyl)ethenyl]amino]-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide
Structure
SMILES: C[C@@H](N=C(O)[C@]1(O)[C@@H](CCNC(=N)N)[C@](O)(CCCNC(=N)N)C(=O)N1CC(O)=N/C=C/C1=CC=C(O)C=C1)C(O)=N/C=C/C1=CC=C(O)C=C1
InChI: InChI=1S/C33H44N10O8/c1-20(27(47)39-17-12-22-5-9-24(45)10-6-22)42-28(48)33(51)25(13-18-41-31(36)37)32(50,14-2-15-40-30(34)35)29(49)43(33)19-26(46)38-16-11-21-3-7-23(44)8-4-21/h3-12,16-17,20,25,44-45,50-51H,2,13-15,18-19H2,1H3,(H,38,46)(H,39,47)(H,42,48)(H4,34,35,40)(H4,36,37,41)/b16-11+,17-12+/t20-,25+,32-,33-/m1/s1
InChIKey: HTEZSPDIMAAWRF-IAUBJXRISA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phorbas tenacior | Phorbas | Hymedesmiidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 708.7770000000003
TPSA？: 322.80000000000007
MolLogP？: 1.0119400000000058
Number of H-Donors: 13
Number of H-Acceptors: 10
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|