(Q105338527)

English

(5R,6R,7S,8S)-5-(Hydroxymethyl)-6,7-dihydroxy-8-(acetylamino)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-acetic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

chemical compound

0 references

mass

299.111735264 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2-((5R,6S,7R,8S)-8-acetamido-6,7-dihydroxy-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₂H₁₇N₃O₆

0 references

canonical SMILES

CC(=O)NC1c2nc(CC(=O)O)cn2C(CO)C(O)C1O

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isomeric SMILES

CC(=O)N[C@H]1c2nc(CC(=O)O)cn2[C@H](CO)[C@@H](O)[C@H]1O

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found in taxon

Streptomyces amakusaensis

3 references

stated in

Benastatins A and B, new inhibitors of glutathione S-transferase, produced by Streptomyces sp. MI384-DF12. II. Structure determination of benastatins A and B

stated in

Nagstatin, a new inhibitor of N-acetyl-beta-D-glucosaminidase, produced by Streptomyces amakusaensis MG846-fF3. Taxonomy, production, isolation, physico-chemical properties and biological activities

stated in

The structure of nagstatin, a new inhibitor of N-acetyl-beta-D-glucosaminidase

Identifiers

InChI

InChI=1S/C12H17N3O6/c1-5(17)13-9-11(21)10(20)7(4-16)15-3-6(2-8(18)19)14-12(9)15/h3,7,9-11,16,20-21H,2,4H2,1H3,(H,13,17)(H,18,19)/t7-,9-,10-,11+/m1/s1

0 references

InChIKey

XPJWMTPRJTUTBX-WKJUBOCMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XPJWMTPRJTUTBX-WKJUBOCMSA-N

ChEBI ID

221197

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C12H17N3O6/c1-5(17)13-9-11(21)10(20)7(4-16)15-3-6(2-8(18)19)14-12(9)15/h3,7,9-11,16,20-21H,2,4H2,1H3,(H,13,17)(H,18,19)/t7-,9-,10-,11+/m1/s1

1 reference

Natural Product Atlas ID

NPA020620

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

XPJWMTPRJTUTBX-WKJUBOCMSA-N

(Q105338527)

(5R,6R,7S,8S)-5-(Hydroxymethyl)-6,7-dihydroxy-8-(acetylamino)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-acetic acid

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Identifiers

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