Rs-DPLA
AlkaPlorer ID: AK021821
Synonym: None
IUPAC Name: [(3R)-1-[[4-[(3R)-3-hydroxydecanoyl]oxy-2-[[3-hydroxy-4-[(3R)-3-hydroxydecanoyl]oxy-5-(3-oxotetradecanoylamino)-6-phosphonooxyoxan-2-yl]methoxy]-6-(hydroxymethyl)-5-phosphonooxyoxan-3-yl]amino]-1-oxotetradecan-3-yl] (E)-tetradec-7-enoate
Structure
SMILES: CCCCCC/C=C/CCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)NC1C(OCC2OC(OP(=O)(O)O)C(NC(=O)CC(=O)CCCCCCCCCCC)C(OC(=O)C[C@H](O)CCCCCCC)C2O)OC(CO)C(OP(=O)(O)O)C1OC(=O)C[C@H](O)CCCCCCC
InChI: InChI=1S/C74H136N2O24P2/c1-6-11-16-21-24-27-28-31-34-39-44-49-64(83)94-59(48-43-38-33-30-26-23-18-13-8-3)53-63(82)76-68-72(98-66(85)52-58(80)47-41-36-20-15-10-5)70(99-101(87,88)89)60(54-77)95-73(68)93-55-61-69(86)71(97-65(84)51-57(79)46-40-35-19-14-9-4)67(74(96-61)100-102(90,91)92)75-62(81)50-56(78)45-42-37-32-29-25-22-17-12-7-2/h27-28,57-61,67-74,77,79-80,86H,6-26,29-55H2,1-5H3,(H,75,81)(H,76,82)(H2,87,88,89)(H2,90,91,92)/b28-27+/t57-,58-,59-,60?,61?,67?,68?,69?,70?,71?,72?,73?,74?/m1/s1
InChIKey: YZTDLNWTOMVTAF-UYRWMZTDSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Rhodopseudomonas | Nitrobacteraceae | Hyphomicrobiales | Alphaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 1499.8400000000006
TPSA？: 396.30000000000007
MolLogP？: 12.989399999999977
Number of H-Donors: 10
Number of H-Acceptors: 20
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|