(Q76309360)

English

1-S-[(1Z)-N-(sulfooxy)pent-4-enimidoyl]-1-thio-beta-D-glucopyranose

chemical compound

In more languages

Statements

type of chemical entity

0 references

[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] N-sulfooxypent-4-enimidothioate

1 reference

based on heuristic

inferred from SMILES

But-3-enylglucosinolate

1 reference

based on heuristic

inferred from SMILES

373.050123188 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

3-Butenylglucosinolate

1 reference

based on heuristic

inferred from InChI

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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₁H₁₉NO₉S₂

0 references

canonical SMILES

O=S(=O)(O)ON=C(SC1OC(CO)C(O)C(O)C1O)CCC=C

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isomeric SMILES

C=CCC/C(=N/OS(=O)(=O)O)/S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O

0 references

1 reference

Glucosinolate variation in leaves of Brassica rapa crops

Identifiers

InChI=1S/C11H19NO9S2/c1-2-3-4-7(12-21-23(17,18)19)22-11-10(16)9(15)8(14)6(5-13)20-11/h2,6,8-11,13-16H,1,3-5H2,(H,17,18,19)/b12-7-/t6-,8-,9+,10-,11+/m1/s1

0 references

PLYQBXHVYUJNQB-IIPHORNXSA-N

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mapping relation type

1 reference

ChEBI release 2021-03-01

UniChem compound ID

1 reference

Sitelinks

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