Bandunamide
AlkaPlorer ID: AK290156
Synonym: None
IUPAC Name: 9,21-bis(hydroxymethyl)-3-(1H-indol-3-ylmethyl)-15-[1H-indol-3-yl(methylsulfanyl)methyl]-1,4,6,13,16,18-hexamethyl-12,24-bis(3-methylsulfanylbutan-2-yl)-1,4,7,10,13,16,19,22-octazacyclotetracosane-2,5,8,11,14,17,20,23-octone
Structure
SMILES: CSC(C)C(C)C1C(=O)NC(CO)C(=O)NC(C)C(=O)N(C)C(C(SC)C2=CNC3=CC=CC=C23)C(=O)N(C)C(C(C)C(C)SC)C(=O)NC(CO)C(=O)NC(C)C(=O)N(C)C(CC2=CNC3=CC=CC=C23)C(=O)N1C
InChI: InChI=1S/C53H76N10O10S3/c1-27(31(5)74-11)42-48(68)58-40(26-65)47(67)57-30(4)51(71)63(10)44(45(76-13)36-24-55-38-21-17-15-19-35(36)38)53(73)62(9)43(28(2)32(6)75-12)49(69)59-39(25-64)46(66)56-29(3)50(70)60(7)41(52(72)61(42)8)22-33-23-54-37-20-16-14-18-34(33)37/h14-21,23-24,27-32,39-45,54-55,64-65H,22,25-26H2,1-13H3,(H,56,66)(H,57,67)(H,58,68)(H,59,69)
InChIKey: UZXWIOMOOJPFLL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces griseovariabilis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1109.4519999999998
TPSA？: 269.68
MolLogP？: 2.3564000000000123
Number of H-Donors: 8
Number of H-Acceptors: 13
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|