Xanthobaccin A
AlkaPlorer ID: AK002576
Synonym: None
IUPAC Name: (1Z,3Z,5R,8S,9S,10S,11S,13R,15R,16R,18Z)-11-ethyl-2,24-dihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.08,15.09,13]octacosa-1,3,18-triene-7,20,27,28-tetrone
Structure
SMILES: CC[C@H]1C[C@@H]2C[C@@H]3[C@@H]4C/C=C\C(O)=NCCC(O)C5N=C(O)/C(=C(O)/C=C\[C@H]4CC(=O)[C@@H]3[C@@H]2[C@H]1C)C5=O
InChI: InChI=1S/C29H38N2O6/c1-3-15-11-17-12-19-18-5-4-6-23(35)30-10-9-21(33)27-28(36)26(29(37)31-27)20(32)8-7-16(18)13-22(34)25(19)24(17)14(15)2/h4,6-8,14-19,21,24-25,27,32-33H,3,5,9-13H2,1-2H3,(H,30,35)(H,31,37)/b6-4-,8-7-,26-20-/t14-,15-,16-,17+,18+,19+,21?,24+,25+,27?/m0/s1
InChIKey: GXFBXYRIFPTSTH-RJFOPRKGSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stenotrophomonas sp. | Stenotrophomonas | Xanthomonadaceae | Xanthomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 510.63100000000026
TPSA？: 139.78
MolLogP？: 4.069600000000002
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|