Epichloenin B
AlkaPlorer ID: AK297509
Synonym: None
IUPAC Name: None
Structure
SMILES: C/C(=C\C(=O)N(O)CCCC1NC(=O)C(CCCN(O)C(=O)/C=C(\C)CCO)NC(=O)C(CCCN(O)C(=O)/C=C(\C)CCO)NC(=O)C(CCC(N)=O)NC(=O)CNC(=O)CNC(=O)CNC1=O)CCO
InChI: InChI=1S/C44H71N11O17/c1-27(12-18-56)21-38(63)53(70)15-4-7-30-41(66)48-25-36(61)46-24-35(60)47-26-37(62)49-33(10-11-34(45)59)44(69)52-32(9-6-17-55(72)40(65)23-29(3)14-20-58)43(68)51-31(42(67)50-30)8-5-16-54(71)39(64)22-28(2)13-19-57/h21-23,30-33,56-58,70-72H,4-20,24-26H2,1-3H3,(H2,45,59)(H,46,61)(H,47,60)(H,48,66)(H,49,62)(H,50,67)(H,51,68)(H,52,69)/b27-21+,28-22+,29-23+
InChIKey: KQYAVEQRCJPIHT-LAMWADGTSA-N
Reference
CAS: 1360614-71-6
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Epichloe festucae | Epichloe | Clavicipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 1026.1119999999996
TPSA？: 429.0999999999999
MolLogP？: -4.466600000000015
Number of H-Donors: 14
Number of H-Acceptors: 17
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|