2-Amino-1,3,4-octadecanetriol; (2S,3S,4R)-form, N-(2R-Hydroxytetracosanoyl), 1-O-[α-D-glucopyranosyl-(1→2)-β-D-galactopyranosyl-(1→6)-β-D-galactopyranosyl-(1→6)-β-D-galactopyranoside]
AlkaPlorer ID: AK286758
Synonym: Neurosporaside
IUPAC Name: N-[1-[6-[[6-[[4,5-dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3,4-dihydroxyoctadecan-2-yl]-2-hydroxytetracosanamide
Structure
SMILES: CCCCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(COC2OC(COC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCC
InChI: InChI=1S/C66H125NO25/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-44(71)62(84)67-42(49(72)43(70)35-33-31-29-27-25-16-14-12-10-8-6-4-2)39-85-63-58(81)55(78)52(75)47(90-63)40-86-64-59(82)56(79)53(76)48(91-64)41-87-66-61(57(80)51(74)46(38-69)89-66)92-65-60(83)54(77)50(73)45(37-68)88-65/h42-61,63-66,68-83H,3-41H2,1-2H3,(H,67,84)
InChIKey: DYFCURYAMUDPOM-UHFFFAOYSA-N
Reference
Neurosporaside, a Tetraglycosylated Sphingolipid from <i>Neurospora crassa</i>
PubChem CID: 75971624
LOTUS: LTS0082097
COCONUT: CNP0110336.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Neurospora crassa | Neurospora | Sordariaceae | Sordariales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 1332.7080000000017
TPSA？: 430.11000000000007
MolLogP？: 2.9865000000000084
Number of H-Donors: 17
Number of H-Acceptors: 25
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|