kinamycin E (Q27121104)

(1R,2R,3R,4S)-11-Diazo-2,3,4,9-tetrahydroxy-2-methyl-5,10-dioxo-2,3,4,5,10,11-hexahydro-1H-benzo[b]fluoren-1-yl acetate (English)

[(1R,2S,3R,4S)-11-diazo-2,3,4,9-tetrahydroxy-2-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[h]fluoren-1-yl] acetate

6 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₁₆N₂O₈

0 references

canonical SMILES

CC(=O)OC1(C2=C(C3=C(C2=[N+]=[N-])C(C4=C(C=CC=C4O)C3=O)=O)C(C(C1(C)O)(O)[H])(O)[H])[H]

1 reference

kinamycin E (English)

6 October 2016

isomeric SMILES

CC(=O)O[C@@]1(C2=C(C3=C(C2=[N+]=[N-])C(C4=C(C=CC=C4O)C3=O)=O)[C@@]([C@]([C@@]1(C)O)(O)[H])(O)[H])[H]

1 reference

kinamycin E (English)

Streptomyces murayamaensis

6 October 2016

found in taxon

2 references

stated in

Identifiers

InChI

InChI=1S/C20H16N2O8/c1-6(23)30-19-13-11(17(27)18(28)20(19,2)29)10-12(14(13)22-21)16(26)9-7(15(10)25)4-3-5-8(9)24/h3-5,17-19,24,27-29H,1-2H3/t17-,18+,19+,20+/m0/s1

1 reference

kinamycin E (English)

FRKARNRSYLXVBE-MTQWCTHYSA-N

6 October 2016

InChIKey

2 references

kinamycin E (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

kinamycin E (English)

6 October 2016

1 reference

matched by identifier from

(1R,2R,3R,4S)-11-Diazo-2,3,4,9-tetrahydroxy-2-methyl-5,10-dioxo-2,3,4,5,10,11-hexahydro-1H-benzo[b]fluoren-1-yl acetate (English)

6 October 2016

2 references

26 December 2021

InChIKey

FRKARNRSYLXVBE-MTQWCTHYSA-N

ChEBI ID

48216

mapping relation type

2 references

kinamycin E (English)