UNPD45441
AlkaPlorer ID: AK575282
Synonym: None
IUPAC Name: [(2R,3S,4S,5R,6S)-6-[[(1R,15S,16R,17S)-16-ethenyl-4,5-dihydroxy-11-oxo-14-oxa-10-azatetracyclo[8.8.0.02,7.012,17]octadeca-2,4,6,12-tetraen-15-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Structure
SMILES: C=C[C@H]1[C@H](O[C@@H]2O[C@H](COC(=O)/C=C/C3=CC=C(O)C(OC)=C3)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCC4=CC(O)=C(O)C=C4[C@H]3C[C@H]21
InChI: InChI=1S/C34H37NO13/c1-3-18-20-12-22-19-13-25(38)24(37)11-17(19)8-9-35(22)32(43)21(20)14-46-33(18)48-34-31(42)30(41)29(40)27(47-34)15-45-28(39)7-5-16-4-6-23(36)26(10-16)44-2/h3-7,10-11,13-14,18,20,22,27,29-31,33-34,36-38,40-42H,1,8-9,12,15H2,2H3/b7-5+/t18-,20+,22-,27-,29-,30+,31-,33+,34+/m1/s1
InChIKey: XVRCEVVAQZTBGK-ZYRCMWDHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alangium platanifolium | Alangium | Cornaceae | Cornales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 667.6640000000001
TPSA？: 204.91
MolLogP？: 1.3808999999999996
Number of H-Donors: 6
Number of H-Acceptors: 13
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|