Ulleungamide C
AlkaPlorer ID: AK327374
Synonym: None
IUPAC Name: (2S)-4-[[(2R)-1-[[(3S,10R,13S,15R,23S,24R,27S,29S)-10-benzyl-15,29-dihydroxy-24-methyl-2,9,12,19,22,26-hexaoxo-25-oxa-1,8,11,18,21-pentazatetracyclo[25.4.0.03,8.013,18]hentriacontan-23-yl]amino]-1-oxo-3-phenylpropan-2-yl]-methylamino]-4-oxo-2-propan-2-ylbutanoic acid
Structure
SMILES: CC(C)[C@H](CC(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N[C@@H]1C(=O)NCC(=O)N2CC[C@@H](O)C[C@H]2C(=O)N[C@H](CC2=CC=CC=C2)C(=O)N2CCCC[C@H]2C(=O)N2CC[C@H](O)C[C@H]2C(=O)O[C@@H]1C)C(=O)O
InChI: InChI=1S/C50H67N7O13/c1-29(2)35(49(67)68)27-41(60)54(4)38(24-32-15-9-6-10-16-32)44(62)53-43-30(3)70-50(69)40-26-34(59)19-22-57(40)48(66)37-17-11-12-20-56(37)47(65)36(23-31-13-7-5-8-14-31)52-45(63)39-25-33(58)18-21-55(39)42(61)28-51-46(43)64/h5-10,13-16,29-30,33-40,43,58-59H,11-12,17-28H2,1-4H3,(H,51,64)(H,52,63)(H,53,62)(H,67,68)/t30-,33-,34+,35+,36-,37+,38-,39+,40+,43+/m1/s1
InChIKey: FMWPSCWFYTWQOJ-QCBHIADPSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces sp. KCB13F003 | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 974.1219999999998
TPSA？: 272.6
MolLogP？: 0.1617000000000147
Number of H-Donors: 6
Number of H-Acceptors: 12
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|