12-epi-fischerindole U

Chemical Formula:

C₂₁H₂₄N₂

Molecular Weight:

304.434 Daltons

Monoisotopic Mass:

305.2017738129 Daltons

SMILES:

C=CC1(C)(CC[CH]2([CH](C([N+]#[C-])1)C3(C4(C=CC=CC(NC(C(C)(C)2)=3)=4))))

InChI:

1S/C21H24N2/c1-6-21(4)12-11-14-17(19(21)22-5)16-13-9-7-8-10-15(13)23-18(16)20(14,2)3/h6-10,14,17,19,23H,1,11-12H2,2-4H3/t14-,17-,19+,21+/m0/s1

InChIKey:

NEYJIGPAQAKWSI-QBGRRASTSA-N

Synonyms

(6aS,9S,10R,10aS)-9-ethenyl-10-isocyano-6,6,9-trimethyl-5,6,6a,7,8,9,10,10a-octahydroindeno[2,1-b]indole

Databases

MetaCyc: CPD-20797

ChEBI: 140442

KEGG: C21840

PubChem (CID): 101677547