validoxylamine A 7'-phosphate

Chemical Formula:

C₁₄H₂₅NO₁₁P

Molecular Weight:

414.325 Daltons

Monoisotopic Mass:

416.132172225 Daltons

SMILES:

C(C1(C(C(C(C(C=1)[N+]C2(C(C(C(C(C2)COP([O-])(=O)[O-])O)O)O))O)O)O))O

InChI:

1S/C14H26NO11P/c16-3-5-1-7(11(19)13(21)9(5)17)15-8-2-6(4-26-27(23,24)25)10(18)14(22)12(8)20/h1,6-22H,2-4H2,(H2,23,24,25)/p-1/t6-,7+,8+,9-,10-,11+,12+,13+,14+/m1/s1

InChIKey:

ZKSTYMJGEHZSFH-MBABXGOBSA-M

Databases

MetaCyc: CPD-18789

ChEBI: 111504

PubChem (CID): 72199465

MetaNetX: MNXM162438

KEGG: C21219