(Q27148399)

inferred from isomeric SMILES

0 references

2 references

inferred from InChIKey

2-hydroxy 3-butenyl glucosinolate

1 reference

1 reference

R-2-Hydroxy-3-butenyl glucosinolate

1 reference

[(Z)-[(3R)-3-hydroxy-1-{[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}pent-4-en-1-ylidene]amino]oxysulfonic acid

1 reference

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z,3S)-3-hydroxy-N-sulfooxypent-4-enimidothioate

1 reference

[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E,3S)-3-hydroxy-N-sulfooxypent-4-enimidothioate

1 reference

chemical formula

C₁₁H₁₉NO₉S₂

1 reference

CHEBI:79351 (English)

8 October 2016

canonical SMILES

C=CC(O)CC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1O

1 reference

inferred from isomeric SMILES

isomeric SMILES

[C@H]1(O[C@@H]([C@@H](O)[C@@H]([C@H]1O)O)CO)SC(=NOS(O)(=O)=O)C[C@@H](C=C)O

0 references

Identifiers

InChI

InChI=1S/C11H19NO10S2/c1-2-5(14)3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(4-13)21-11/h2,5-6,8-11,13-17H,1,3-4H2,(H,18,19,20)/t5-,6-,8-,9+,10-,11+/m1/s1

0 references

1 reference

stated in

ChEBI release 2020-09-01

2 references

epi-progoitrin (English)

8 October 2016

https://commonchemistry.cas.org/detail?cas_rn=19237-18-4

10 April 2021

PubChem CID

3035040

1 reference

matched by identifier from

Reaxys registry number

9951982

1 reference

epi-progoitrin (English)

8 October 2016

ChEBI ID

79351

mapping relation type

2 references

epi-progoitrin (English)

matched by identifier from

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C11H19NO10S2/c1-2-5(14)3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(4-13)21-11/h2,5-6,8-11,13-17H,1,3-4H2,(H,18,19,20)/t5-,6-,8-,9+,10-,11+/m1/s1

1 reference

1 reference

matched by identifier from