Actinomycin Au6b
AlkaPlorer ID: AK102562
Synonym: None
IUPAC Name: 2-amino-1-N-(3-butan-2-yl-7,11,14-trimethyl-2,5,9,12,15-pentaoxo-10-propan-2-yl-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl)-4,6-dimethyl-3-oxo-9-N-[7,11,14-trimethyl-3-(2-methylpropyl)-2,5,9,12,15-pentaoxo-10-propan-2-yl-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]phenoxazine-1,9-dicarboxamide
Structure
SMILES: CCC(C)C1N=C(O)C(N=C(O)C2=C(N)C(=O)C(C)=C3OC4=C(C)C=CC(C(O)=NC5C(O)=NC(CC(C)C)C(=O)N6CCCC6C(=O)N(C)CC(=O)N(C)C(C(C)C)C(=O)OC5C)=C4N=C32)C(C)OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C2CCCN2C1=O
InChI: InChI=1S/C64H90N12O16/c1-17-32(8)45-62(87)76-25-19-21-40(76)61(86)72(14)28-42(78)74(16)51(31(6)7)64(89)91-36(12)47(58(83)68-45)70-56(81)43-44(65)52(79)34(10)54-49(43)67-48-37(23-22-33(9)53(48)92-54)55(80)69-46-35(11)90-63(88)50(30(4)5)73(15)41(77)27-71(13)60(85)39-20-18-24-75(39)59(84)38(26-29(2)3)66-57(46)82/h22-23,29-32,35-36,38-40,45-47,50-51H,17-21,24-28,65H2,1-16H3,(H,66,82)(H,68,83)(H,69,80)(H,70,81)
InChIKey: AJOMZCFRTKDCIB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Actinomyces | Actinomycetaceae | Actinomycetales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1283.4919999999993
TPSA？: 373.94
MolLogP？: 4.336040000000015
Number of H-Donors: 5
Number of H-Acceptors: 18
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|