Dictyonamide A; 3''-O-β-D-Fructofuranoside
AlkaPlorer ID: AK295548
Synonym: Dictyonamide B
IUPAC Name: 2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-(2-aminopropanoylamino)-3-hydroxybutanoyl]-methylamino]-3-[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxybutanoyl]-methylamino]-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]amino]-3-methylpentanoyl]-methylamino]-3-methylbutanoyl]-methylamino]acetyl]amino]benzoic acid
Structure
SMILES: CCC(C)C(NC(=O)C(C(C)C)N(C)C(=O)C(C(C)C)N(C)C(=O)C(C(C)C)N(C)C(=O)C(NC(=O)C(C(C)C)N(C)C(=O)C(C(C)OC1(CO)OC(CO)C(O)C1O)N(C)C(=O)C(NC(=O)C(C)N)C(C)O)C(C)C)C(=O)N(C)C(C(=O)N(C)CC(=O)NC1=CC=CC=C1C(=O)O)C(C)C
InChI: InChI=1S/C69H118N12O20/c1-25-39(14)48(62(92)78(21)52(36(8)9)64(94)75(18)30-46(85)71-44-29-27-26-28-43(44)68(98)99)73-60(90)51(35(6)7)76(19)65(95)54(38(12)13)80(23)66(96)53(37(10)11)79(22)61(91)47(33(2)3)72-59(89)50(34(4)5)77(20)67(97)55(81(24)63(93)49(41(16)84)74-58(88)40(15)70)42(17)100-69(32-83)57(87)56(86)45(31-82)101-69/h26-29,33-42,45,47-57,82-84,86-87H,25,30-32,70H2,1-24H3,(H,71,85)(H,72,89)(H,73,90)(H,74,88)(H,98,99)
InChIKey: ZKRHKJXJSFWIBA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ceratodictyon spongiosum | Ceratodictyon | Lomentariaceae | Rhodymeniales | Florideophyceae | Rhodophyta | None | Eukaryota |
Properties Information
Molecule Weight: 1435.7669999999994
TPSA？: 441.4999999999999
MolLogP？: -0.8852000000000186
Number of H-Donors: 11
Number of H-Acceptors: 20
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|