Clavariopsin H
AlkaPlorer ID: AK410001
Synonym: None
IUPAC Name: 2-[15,18-di(butan-2-yl)-6-[(4-methoxyphenyl)methyl]-10,16,19,22,28-pentamethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-3,9,24,27-tetra(propan-2-yl)-4-oxa-1,7,10,13,16,19,22,25,28-nonazabicyclo[28.3.0]tritriacontan-21-yl]acetic acid
Structure
SMILES: CCC(C)C1C(=O)N(C)C(C(C)CC)C(O)=NCC(=O)N(C)C(C(C)C)C(O)=NC(CC2=CC=C(OC)C=C2)C(=O)OC(C(C)C)C(=O)N2CCCC2C(=O)N(C)C(C(C)C)C(O)=NC(C(C)C)C(=O)N(C)C(CC(=O)O)C(=O)N1C
InChI: InChI=1S/C58H93N9O14/c1-19-35(11)47-50(71)59-30-42(68)63(14)45(32(5)6)51(72)60-39(28-37-23-25-38(80-18)26-24-37)58(79)81-49(34(9)10)57(78)67-27-21-22-40(67)53(74)64(15)46(33(7)8)52(73)61-44(31(3)4)55(76)62(13)41(29-43(69)70)54(75)66(17)48(36(12)20-2)56(77)65(47)16/h23-26,31-36,39-41,44-49H,19-22,27-30H2,1-18H3,(H,59,71)(H,60,72)(H,61,73)(H,69,70)
InChIKey: IGPFOHANIKPCAO-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Clavariopsis aquatica | Clavariopsis | None | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 1140.4309999999996
TPSA？: 292.46
MolLogP？: 5.086700000000016
Number of H-Donors: 4
Number of H-Acceptors: 13
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|