Waikikiamide C
AlkaPlorer ID: AK327977
Synonym: None
IUPAC Name: (1S,7S,9S,11R)-1'-[[(1R,2S,10S,11R,17S,19S)-14-hydroxy-2,11-dimethoxy-9,9,16,16-tetramethyl-24,26-dioxo-8-oxa-14,23,25-triazaheptacyclo[17.5.2.01,17.03,15.04,13.07,12.019,23]hexacosa-3(15),4(13),5,7(12)-tetraen-10-yl]oxy]-7',7',10,10-tetramethylspiro[3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane-11,3'-pyrano[2,3-g]indole]-2,2',14-trione
Structure
SMILES: CO[C@@H]1C2=C3C(=CC=C2OC(C)(C)[C@H]1ON1C(=O)[C@@]2(C[C@@]45NC(=O)[C@]6(CCCN6C4=O)C[C@H]5C2(C)C)C2=CC=C4OC(C)(C)C=CC4=C21)C1=C(N3O)C(C)(C)[C@@H]2C[C@]34CCCN3C(=O)[C@]2(NC4=O)[C@H]1OC
InChI: InChI=1S/C54H62N6O11/c1-46(2)20-17-26-29(69-46)16-14-28-35(26)60(43(63)52(28)25-53-32(48(52,5)6)24-51(41(61)55-53)19-11-21-57(51)44(53)64)71-40-37(67-9)34-30(70-49(40,7)8)15-13-27-33-38(59(66)36(27)34)47(3,4)31-23-50-18-12-22-58(50)45(65)54(31,39(33)68-10)56-42(50)62/h13-17,20,31-32,37,39-40,66H,11-12,18-19,21-25H2,1-10H3,(H,55,61)(H,56,62)/t31-,32-,37+,39-,40-,50-,51-,52+,53-,54+/m0/s1
InChIKey: GKOOPMJBANLQKC-DXXYEOPISA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus sp. FM242 | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 971.1209999999998
TPSA？: 190.44
MolLogP？: 5.414100000000005
Number of H-Donors: 3
Number of H-Acceptors: 12
RingCount: 16
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|