LSM-1590 (Q27163543)

Spectrum2_000920 (English)

9 October 2016

chemical formula

C₁₅H₁₈N₄O₅

1 reference

Spectrum2_000920 (English)

9 October 2016

canonical SMILES

CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)OC)N4)N

1 reference

Spectrum2_000920 (English)

9 October 2016

isomeric SMILES

CC1=C(C(=O)C2=C(C1=O)N3CC4[C@H]([C@]3([C@H]2COC(=O)N)OC)N4)N

1 reference

Spectrum2_000920 (English)

InChI=1S/C15H18N4O5/c1-5-9(16)12(21)8-6(4-24-14(17)22)15(23-2)13-7(18-13)3-19(15)10(8)11(5)20/h6-7,13,18H,3-4,16H2,1-2H3,(H2,17,22)/t6-,7?,13+,15-/m0/s1

9 October 2016

Identifiers

InChI

1 reference

Spectrum2_000920 (English)

NWIBSHFKIJFRCO-CPKMXBGFSA-N

9 October 2016

InChIKey

2 references

Spectrum2_000920 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

[(8R,8aS,8bR)-6-Amino-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl carbamate (English)

9 October 2016

1 reference

Spectrum2_000920 (English)

9 October 2016

ChEBI ID

91730

mapping relation type

2 references

LSM-1590 (English)