UNPD61252
AlkaPlorer ID: AK524331
Synonym: None
IUPAC Name: (1S,2R)-1-(4-hydroxy-3-methoxyphenyl)-7-[(Z)-1-(4-hydroxy-3-methoxyphenyl)-3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-en-2-yl]oxy-2-N,3-N-bis[2-(4-hydroxyphenyl)ethyl]-6-methoxy-1,2-dihydronaphthalene-2,3-dicarboxamide
Structure
SMILES: COC1=CC(/C=C(\OC2=CC3=C(C=C(C(=O)NCCC4=CC=C(O)C=C4)[C@H](C(O)=NCCC4=CC=C(O)C=C4)[C@H]3C3=CC=C(O)C(OC)=C3)C=C2OC)C(O)=NCCC2=CC=C(O)C=C2)=CC=C1O
InChI: InChI=1S/C54H53N3O12/c1-66-45-26-35(10-18-43(45)61)27-49(53(64)56-24-21-33-6-14-39(59)15-7-33)69-48-31-41-37(30-47(48)68-3)28-42(52(63)55-23-20-32-4-12-38(58)13-5-32)51(50(41)36-11-19-44(62)46(29-36)67-2)54(65)57-25-22-34-8-16-40(60)17-9-34/h4-19,26-31,50-51,58-62H,20-25H2,1-3H3,(H,55,63)(H,56,64)(H,57,65)/b49-27-/t50-,51-/m0/s1
InChIKey: SMONCAXYSFVMCB-ZWSXQOBLSA-N
Reference
Lignanamides and Sesquiterpenoids from Stems of <i>Mitrephora thorelii</i>
PubChem CID: 163189374
LOTUS: LTS0250699
SuperNatural Ⅲ: SN0349644-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mitrephora tomentosa | Mitrephora | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 936.027
TPSA？: 232.35
MolLogP？: 8.562700000000005
Number of H-Donors: 8
Number of H-Acceptors: 12
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|