Enacyloxin IIb; 15'S-Alcohol
AlkaPlorer ID: AK297423
Synonym: Enacyloxin IVb
IUPAC Name: 4-[(2E,4E,6E,8E,10Z,20E)-19-carbamoyloxy-11,18-dichloro-13,14,15,17-tetrahydroxy-6,12-dimethyltricosa-2,4,6,8,10,20-hexaenoyl]oxy-3-hydroxycyclohexane-1-carboxylic acid
Structure
SMILES: CC/C=C/C(OC(N)=O)C(Cl)C(O)CC(O)C(O)C(O)C(C)/C(Cl)=C/C=C/C=C(C)/C=C/C=C/C(=O)OC1CCC(C(=O)O)CC1O
InChI: InChI=1S/C33H47Cl2NO11/c1-4-5-13-27(47-33(36)45)29(35)24(38)18-25(39)31(42)30(41)20(3)22(34)12-8-6-10-19(2)11-7-9-14-28(40)46-26-16-15-21(32(43)44)17-23(26)37/h5-14,20-21,23-27,29-31,37-39,41-42H,4,15-18H2,1-3H3,(H2,36,45)(H,43,44)/b8-6+,11-7+,13-5+,14-9+,19-10+,22-12-
InChIKey: BLLRSFRMLVNGSZ-PHMKDSOOSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Frateuria sp. | Frateuria | Rhodanobacteraceae | Xanthomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 704.6410000000001
TPSA？: 217.07
MolLogP？: 3.3887000000000023
Number of H-Donors: 7
Number of H-Acceptors: 10
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|