UNPD15571
AlkaPlorer ID: AK319576
Synonym: None
IUPAC Name: None
Structure
SMILES: ON=C1C(O)=NCCC2=CC(=C(O)C(Br)=C2)OC2=C(Br)C=C(C=C2Br)CCN=C(O)/C(=N/O)CC2=CC(=C(O)C(Br)=C2)OC2=C(Br)C=C(C=C2Br)[C@@H]1O
InChI: InChI=1S/C34H26Br6N4O9/c35-18-5-15-2-4-42-34(49)27(44-51)28(45)17-12-22(39)32(23(40)13-17)53-26-11-16(8-19(36)30(26)47)9-24(43-50)33(48)41-3-1-14-6-20(37)31(21(38)7-14)52-25(10-15)29(18)46/h5-8,10-13,28,45-47,50-51H,1-4,9H2,(H,41,48)(H,42,49)/b43-24+,44-27?/t28-/m0/s1
InChIKey: MHAGECXZXFMEGD-RDYLSQOQSA-N
Reference
NPASS: NPC272310
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Melicope subunifoliolata | Melicope | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 1114.025
TPSA？: 209.51
MolLogP？: 10.205499999999992
Number of H-Donors: 7
Number of H-Acceptors: 11
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|