Amidepsine H
AlkaPlorer ID: AK068677
Synonym: None
IUPAC Name: (2S)-2-[[4-[2-[(2S,3R,4S,5S,6R)-3-acetyloxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-(2,4-dimethoxy-6-methylbenzoyl)oxy-6-methylbenzoyl]oxy-2-hydroxy-6-methylbenzoyl]amino]propanoic acid
Structure
SMILES: COC1=CC(C)=C(C(=O)OC2=CC(C)=C(C(=O)OC3=CC(C)=C(C(O)=N[C@@H](C)C(=O)O)C(O)=C3)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3OC(C)=O)=C2)C(OC)=C1
InChI: InChI=1S/C37H41NO17/c1-15-9-21(11-23(41)27(15)33(44)38-18(4)34(45)46)52-36(48)29-17(3)10-22(53-35(47)28-16(2)8-20(49-6)12-24(28)50-7)13-25(29)54-37-32(51-19(5)40)31(43)30(42)26(14-39)55-37/h8-13,18,26,30-32,37,39,41-43H,14H2,1-7H3,(H,38,44)(H,45,46)/t18-,26+,30+,31-,32+,37+/m0/s1
InChIKey: JBSTZXRMJYWRCO-UAFDTWFTSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Humicola sp. | Humicola | Chaetomiaceae | Sordariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 771.7250000000004
TPSA？: 266.62999999999994
MolLogP？: 2.30026
Number of H-Donors: 6
Number of H-Acceptors: 16
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|