desulfosinalbin

Chemical Formula:

C₁₄H₁₉NO₇S

Molecular Weight:

345.367 Daltons

Monoisotopic Mass:

345.0882226598 Daltons

SMILES:

C(O)C1(C(C(O)C(O)C(O1)SC(=NO)CC2(C=CC(O)=CC=2))O)

InChI:

1S/C14H19NO7S/c16-6-9-11(18)12(19)13(20)14(22-9)23-10(15-21)5-7-1-3-8(17)4-2-7/h1-4,9,11-14,16-21H,5-6H2/b15-10-/t9-,11-,12+,13-,14+/m1/s1

InChIKey:

SOUNOQPUSGGIJJ-RFEZBLSLSA-N

Databases

MetaCyc: CPD-20054

ChEBI: 80982

KEGG: C17240

PubChem (CID): 46173871