Epichloenin A; N-Trideoxy
AlkaPlorer ID: AK297508
Synonym: Epichloeamide
IUPAC Name: None
Structure
SMILES: C/C(=C\C(=O)NCCCC1NC(=O)C(CCCNC(=O)/C=C(\C)CCO)NC(=O)C(CCCNC(=O)/C=C(\C)CCO)NC(=O)C(CCC(N)=O)NC(=O)CNC(=O)CNC(=O)CNC(=O)CNC1=O)CCO
InChI: InChI=1S/C46H74N12O15/c1-28(12-18-59)21-36(63)48-15-4-7-31-43(70)54-26-41(68)52-24-39(66)51-25-40(67)53-27-42(69)55-34(10-11-35(47)62)46(73)58-33(9-6-17-50-38(65)23-30(3)14-20-61)45(72)57-32(44(71)56-31)8-5-16-49-37(64)22-29(2)13-19-60/h21-23,31-34,59-61H,4-20,24-27H2,1-3H3,(H2,47,62)(H,48,63)(H,49,64)(H,50,65)(H,51,66)(H,52,68)(H,53,67)(H,54,70)(H,55,69)(H,56,71)(H,57,72)(H,58,73)/b28-21+,29-22+,30-23+
InChIKey: UXEHKAAIZITKPW-ILKWKBCYSA-N
Reference
CAS: 1360614-72-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Epichloe festucae | Epichloe | Clavicipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 1035.1669999999997
TPSA？: 423.8799999999999
MolLogP？: -5.655200000000024
Number of H-Donors: 15
Number of H-Acceptors: 15
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|