(1S,2R,4R,5R,13R)-14'-hydroxy-8,10',15'-trimethoxy-14-methyl-6,12'-dioxa-4',14-diazaspiro[pentacyclo[9.5.1.0¹,⁵.0²,¹³.0⁷,¹⁷]heptadecane-4,3'-pentacyclo[9.7.2.0⁴,¹⁹.0⁷,²⁰.0¹³,¹⁸]icosan]-1'(19'),5',7,7'(20'),8',9,10',11(17),13',15',17'-undecaen-2'-one
AlkaPlorer ID: AK566067
Synonym: None
IUPAC Name: (1'R,2'S,3S,13'R)-14-hydroxy-8',10,15-trimethoxy-14'-methylspiro[12-oxa-4-azapentacyclo[9.7.2.04,19.07,20.013,18]icosa-1(19),5,7(20),8,10,13(18),14,16-octaene-3,4'-6-oxa-14-azapentacyclo[9.5.1.01,5.02,13.07,17]heptadeca-7,9,11(17)-triene]-2-one
Structure
SMILES: COC1=CC=C2C3=C4C5=C(OC2=C1O)C(OC)=CC=C5C=CN4[C@]1(C[C@@H]2[C@H]4CC5=CC=C(OC)C6=C5[C@]2(CCN4C)C1O6)C3=O
InChI: InChI=1S/C36H32N2O7/c1-37-14-12-35-20-16-36(34(35)45-32-24(43-4)9-6-18(27(32)35)15-21(20)37)33(40)26-19-7-10-22(41-2)29(39)30(19)44-31-23(42-3)8-5-17-11-13-38(36)28(26)25(17)31/h5-11,13,20-21,34,39H,12,14-16H2,1-4H3/t20-,21-,34?,35-,36-/m1/s1
InChIKey: XAFDXNDGYKGJRI-WCWDLXQSSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dicentra canadensis | Dicentra | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 604.6590000000002
TPSA？: 89.93
MolLogP？: 4.978900000000007
Number of H-Donors: 1
Number of H-Acceptors: 9
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|