Mycoplanecin A
AlkaPlorer ID: AK128587
Synonym: None
IUPAC Name: (2S,4S)-4-ethyl-N-methyl-1-[(2S)-3-methyl-2-[methyl(2-oxobutanoyl)amino]butanoyl]-N-[(3S,6S,9R,11R,15R,18S,19R,25S,28S)-4,11,19,26-tetramethyl-6-(3-methylbutyl)-15,25-bis(2-methylpropyl)-2,5,8,14,17,21,24,27-octaoxo-3-propan-2-yl-20-oxa-1,4,7,13,16,23,26-heptazatricyclo[26.3.0.09,13]hentriacontan-18-yl]pyrrolidine-2-carboxamide
Structure
SMILES: CCC(=O)C(=O)N(C)[C@H](C(=O)N1C[C@@H](CC)C[C@H]1C(=O)N(C)[C@@H]1C(O)=N[C@H](CC(C)C)C(=O)N2C[C@H](C)C[C@@H]2C(O)=N[C@@H](CCC(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N2CCC[C@H]2C(=O)N(C)[C@@H](CC(C)C)C(O)=NCC(=O)O[C@@H]1C)C(C)C
InChI: InChI=1S/C61H102N10O13/c1-19-40-29-46(71(32-40)61(83)50(37(11)12)67(17)59(81)47(72)20-2)58(80)68(18)51-39(14)84-48(73)30-62-52(74)44(27-35(7)8)65(15)57(79)43-22-21-25-69(43)60(82)49(36(9)10)66(16)55(77)41(24-23-33(3)4)63-53(75)45-28-38(13)31-70(45)56(78)42(26-34(5)6)64-54(51)76/h33-46,49-51H,19-32H2,1-18H3,(H,62,74)(H,63,75)(H,64,76)/t38-,39-,40+,41+,42-,43+,44+,45-,46+,49+,50+,51+/m1/s1
InChIKey: ICFLLAYTOVAMGO-ORZQNBSVSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Actinoplanes awajinensis | Actinoplanes | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1183.543999999999
TPSA？: 283.31
MolLogP？: 5.521000000000019
Number of H-Donors: 3
Number of H-Acceptors: 13
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|