(Q27133517)

C20 sphinganine (English)

7 October 2016

chemical formula

C₂₀H₄₄NO₂⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCCCCCCCCCCCCC(C(CO)[NH3+])O

1 reference

C20 sphinganine (English)

7 October 2016

isomeric SMILES

CCCCCCCCCCCCCCCCC[C@H]([C@H](CO)[NH3+])O

1 reference

C20 sphinganine (English)

InChI=1S/C20H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)19(21)18-22/h19-20,22-23H,2-18,21H2,1H3/p+1/t19-,20+/m0/s1

7 October 2016

Identifiers

InChI

1 reference

C20 sphinganine (English)

UFMHYBVQZSPWSS-VQTJNVASSA-O

7 October 2016

InChIKey

2 references

C20 sphinganine (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2S,3R)-1,3-Dihydroxy-2-icosanaminium (English)

7 October 2016

2 references

C20 sphinganine (English)

matched by identifier from

7 October 2016

InChIKey

UFMHYBVQZSPWSS-VQTJNVASSA-O

ChEBI ID

64887

mapping relation type

2 references

C20 sphinganine(1+) (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C20H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)19(21)18-22/h19-20,22-23H,2-18,21H2,1H3/p+1/t19-,20+/m0/s1

1 reference

2 references

https://www.swisslipids.org/#/downloads