UNPD135606
AlkaPlorer ID: AK318551
Synonym: None
IUPAC Name: None
Structure
SMILES: O=C(O)CC(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](OC2=CC3=C(C=C2O)/[N+](=C\C=C2/C=C(C(=O)O)N[C@@H](C(=O)O)C2)[C@H](C(=O)[O-])C3)O[C@@H]1CO
InChI: InChI=1S/C27H28N2O16/c30-9-18-23(45-20(34)8-19(32)33)21(35)22(36)27(44-18)43-17-6-11-5-15(26(41)42)29(14(11)7-16(17)31)2-1-10-3-12(24(37)38)28-13(4-10)25(39)40/h1-3,6-7,13,15,18,21-23,27,30,35-36H,4-5,8-9H2,(H5,31,32,33,37,38,39,40,41,42)/t13-,15+,18-,21-,22-,23-,27-/m1/s1
InChIKey: UYLHQHLKCSJVJP-MBVMZUPLSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stachys affinis | Stachys | Lamiaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Acronychia pedunculata | Acronychia | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Stylocheilus longicauda | Stylocheilus | Aplysiidae | Aplysiida | Gastropoda | Mollusca | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 636.5190000000002
TPSA？: 292.75
MolLogP？: -3.672699999999993
Number of H-Donors: 8
Number of H-Acceptors: 14
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|