Aristophyll-C
AlkaPlorer ID: AK062935
Synonym: ''
IUPAC Name: [(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl] 3-[(22S,23R)-17-ethenyl-12-ethyl-13,18,22,27-tetramethyl-3,5-dioxo-4-oxa-8,24,25,26-tetrazahexacyclo[19.2.1.16,9.111,14.116,19.02,7]heptacosa-1,6,9(27),10,12,14(26),15,17,19(25),20-decaen-23-yl]propanoate
Structure
SMILES: C=CC1=C2C=C3N=C(C=C4NC5=C(C(=O)OC(=O)C5=C4C)C4=NC(=CC(=C1C)N2)[C@@H](C)[C@H]4CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(CC)=C3C
InChI: InChI=1S/C53H70N4O5/c1-12-38-34(8)41-27-43-36(10)40(23-24-47(58)61-26-25-33(7)22-16-21-32(6)20-15-19-31(5)18-14-17-30(3)4)50(56-43)49-51-48(52(59)62-53(49)60)37(11)44(57-51)29-46-39(13-2)35(9)42(55-46)28-45(38)54-41/h12,25,27-32,36,40,54,57H,1,13-24,26H2,2-11H3/b33-25+,41-27?,42-28?,43-27?,44-29?,45-28?,46-29?,50-49?/t31-,32-,36+,40-/m1/s1
InChIKey: WSSDCOMNIRJABY-PSGYQTALSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cinnamomum subavenium | Cinnamomum | Lauraceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 843.1659999999994
TPSA？: 127.03000000000002
MolLogP？: 13.822039999999973
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|