(1S,15R)-15-(2-hydroxyethoxy)-10,19,24-trimethoxy-29-methyl-17-[2-(methylamino)ethyl]-8,22-dioxa-29-azahexacyclo[21.6.2.1³,⁷.1⁹,¹³.0¹⁶,²¹.0²⁶,³⁰]tritriaconta-3(33),4,6,9(32),10,12,16(21),17,19,23(31),24,26(30)-dodecaen-20-ol
AlkaPlorer ID: AK147074
Synonym: None
IUPAC Name: (1S,15R)-15-(2-hydroxyethoxy)-10,19,24-trimethoxy-29-methyl-17-[2-(methylamino)ethyl]-8,22-dioxa-29-azahexacyclo[21.6.2.13,7.19,13.016,21.026,30]tritriaconta-3(33),4,6,9,11,13(32),16(21),17,19,23,25,30-dodecaen-20-ol
Structure
SMILES: CNCCC1=CC(OC)=C(O)C2=C1[C@H](OCCO)CC1=CC=C(OC)C(=C1)OC1=CC(=CC=C1)C[C@H]1C3=C(C=C(OC)C(=C3)O2)CCN1C
InChI: InChI=1S/C39H46N2O8/c1-40-13-11-27-22-36(46-5)38(43)39-37(27)35(47-16-15-42)20-25-9-10-31(44-3)33(19-25)48-28-8-6-7-24(17-28)18-30-29-23-34(49-39)32(45-4)21-26(29)12-14-41(30)2/h6-10,17,19,21-23,30,35,40,42-43H,11-16,18,20H2,1-5H3/t30-,35+/m0/s1
InChIKey: OXOUXFFHFUPFLS-LWQYYNMXSA-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: 670.803
TPSA？: 111.11
MolLogP？: 6.142300000000008
Number of H-Donors: 3
Number of H-Acceptors: 10
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|