streptamine (Q27103421)

Streptamine (English)

5 October 2016

chemical formula

C₆H₁₄N₂O₄

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1(C(C(C(C(C1(O)[H])(O)[H])(O)[H])(N)[H])(O)[H])(N)[H]

1 reference

streptamine (English)

5 October 2016

isomeric SMILES

[C@]1([C@@]([C@]([C@@]([C@]([C@@]1(O)[H])(O)[H])(O)[H])(N)[H])(O)[H])(N)[H]

1 reference

streptamine (English)

InChI=1S/C6H14N2O4/c7-1-3(9)2(8)5(11)6(12)4(1)10/h1-6,9-12H,7-8H2/t1-,2+,3-,4+,5-,6-

5 October 2016

Identifiers

InChI

1 reference

streptamine (English)

5 October 2016

2 references

streptamine (English)

5 October 2016

stated in

ChEBI release 2020-09-01

2 references

streptamine (English)

5 October 2016

https://commonchemistry.cas.org/detail?cas_rn=488-52-8

9 April 2021

1 reference

Streptamine (English)

5 October 2016

Reaxys registry number

2802452

1 reference

streptamine (English)

5 October 2016

26714

1 reference

streptamine (English)

5 October 2016

ChEBI ID

27955

mapping relation type

2 references

streptamine (English)

matched by identifier from

5 October 2016

International Chemical Identifier

InChI

InChI=1S/C6H14N2O4/c7-1-3(9)2(8)5(11)6(12)4(1)10/h1-6,9-12H,7-8H2/t1-,2+,3-,4+,5-,6-

SureChEMBL ID

SCHEMBL1133676

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

matched by identifier from

DSSTox substance ID

DTXSID301318160

1 reference