(1S,16S)-10-methoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.2³,⁶.1⁸,¹².1¹⁸,²².0²⁷,³¹.0¹⁶,³⁴]hexatriaconta-3,5,8(34),9,11,18(33),19,21,24(32),25,27(31),35-dodecaene-9,21,25-triol
AlkaPlorer ID: AK144197
Synonym: None
IUPAC Name: (1S,16S)-10-methoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21,25-triol
Structure
SMILES: COC1=C(O)C2=C3C(=C1)CCN(C)[C@H]3CC1=CC=C(O)C(=C1)OC1=C(O)C=C3CCN(C)[C@@H](CC4=CC=C(C=C4)O2)C3=C1
InChI: InChI=1S/C35H36N2O6/c1-36-12-10-22-17-29(39)31-19-25(22)26(36)14-20-4-7-24(8-5-20)42-35-33-23(18-32(41-3)34(35)40)11-13-37(2)27(33)15-21-6-9-28(38)30(16-21)43-31/h4-9,16-19,26-27,38-40H,10-15H2,1-3H3/t26-,27-/m0/s1
InChIKey: KOFWKVJRSNUJGT-SVBPBHIXSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Asparagus umbellatus | Asparagus | Asparagaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Chondrodendron microphyllum | Chondrodendron | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Cyclea peltata | Cyclea | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 580.6810000000003
TPSA？: 94.86
MolLogP？: 6.253400000000007
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|