dTDP-N-hydroxy-β-L-evernosamine

Chemical Formula:

C₁₈H₂₉N₃O₁₄P₂

Molecular Weight:

573.386 Daltons

Monoisotopic Mass:

575.1281257400999 Daltons

SMILES:

CC1(C(=O)NC(=O)N(C=1)C2(OC(C(O)C2)COP([O-])(=O)OP([O-])(=O)OC3(OC(C)C(OC)C(C)(NO)C3)))

InChI:

1S/C18H31N3O14P2/c1-9-7-21(17(24)19-16(9)23)13-5-11(22)12(33-13)8-31-36(26,27)35-37(28,29)34-14-6-18(3,20-25)15(30-4)10(2)32-14/h7,10-15,20,22,25H,5-6,8H2,1-4H3,(H,26,27)(H,28,29)(H,19,23,24)/p-2/t10-,11-,12+,13+,14+,15-,18-/m0/s1

InChIKey:

SNTNNQMUKUWPMM-JGQKHYKVSA-L

Databases

MetaCyc: CPD-16426

PubChem (CID): 86289136

ChEBI: 77143

MetaNetX: MNXM145764

KEGG: C20766