Results for:
PubChem ID: 122121

(2S,3S,4R)-2-aminooctadecane-1,3,4-triol

Compound Details

Synonymous names	phytosphingosine 554-62-1 (2S,3S,4R)-2-aminooctadecane-1,3,4-triol 4-D-Hydroxysphinganine D-Ribo-phytosphingosine C18-Phytosphingosine 388566-94-7 DS-phytosphingosine (+)-D-ribo-Phytosphingosine UNII-GIN46U9Q2Q 1,3,4-Octadecanetriol, 2-amino-, (2S,3S,4R)- GIN46U9Q2Q 4-R-hydroxyoctadecasphinganine 4R-hydroxysphinganine CHEBI:46961 CYTOMIDE PGS BIOMIDE PS D-ribo Phytosphingosine N-Dodecanoyl-NBD-phytosphingosine D-Ribo-1,3,4-trihydroxy-2-aminooctadecane SPHINGANINE, 4-D-HYDROXY DTXSID80203951 EC 439-210-6 4-hydroxysphinganine 1,3,4-Octadecanetriol, 2-amino-, (2S-(2R*,3R*,4S*))- (2S,3S,4R)-2-Amino-1,3,4-octadecanetriol 4R-hydroxasphinganine 1,3,4-OCTADECANETRIOL, 2-AMINO-, D-RIBO- phytosphingosine (C18) 4R-hydroxysphinganine (C18) D-ribo-4-hydroxysphinganine (C18) t18:0 C18H39NO3 Phytosphingosin 4D-Hydroxysphinganine 4-D-hydroxy-Sphinganine SCHEMBL20110 C18-PHS PHYTOSPHINGOSINE [INCI] CHEMBL236036 DTXCID10126442 PHYTOSPHINGOSINE [WHO-DD] LMSP01030001 MFCD02259274 AKOS015949172 AKOS016015084 CCG-208251 CS-W012019 DB14119 FS-5977 HY-W011303 D-ribo-2-amino-1,3,4-Octadecanetriol SMP2_000142 NCGC00163609-01 NS00009822 P1765 A870186 SR-05000002328 J-501034 Q3746193 SR-05000002328-2 (2S,3S,4R)-2-Amino-1,3,4-octadecanetriol, AldrichCPR [2S-(2R*,3R*,4S*)]-2-amino-1,3,4-Octadecanetriol D-ribo-Phytosphingosine, 4-hydroxysphinganine (Saccharomyces Cerevisiae), powder
Microorganism:	Yes
IUPAC name	(2S,3S,4R)-2-aminooctadecane-1,3,4-triol
SMILES	CCCCCCCCCCCCCCC(C(C(CO)N)O)O
Inchi	InChI=1S/C18H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h16-18,20-22H,2-15,19H2,1H3/t16-,17+,18-/m0/s1
Formula	C18H39NO3
PubChem ID	122121
Molweight	317.5
LogP	4.6
Atoms	22
Bonds	16
H-bond Acceptor	4
H-bond Donor	4
Chemical Classification	alcohols nitrogen compounds amines
CHEBI-ID	46961
Supernatural-ID	SN0003610-03

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Bacteroides Thetaiotaomicron NA NA Bryant et al. 2017
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Bacteroides Thetaiotaomicron Brain Heart Infusion medium with 0.001% hemin RP/UPLC-MS/MS (ESI+) (-ESI) no