FAD

Chemical Formula:

C₂₇H₃₀N₉O₁₅P₂

Molecular Weight:

782.533 Daltons

Monoisotopic Mass:

785.1571344575999 Daltons

SMILES:

CC6(=C(C)C=C5(C(N=C1(C(=O)[N-]C(=O)N=C1N(CC(C(O)C(O)COP(OP([O-])(OCC4(C(O)C(O)C(N3(C=NC2(C(N)=NC=NC=23)))O4))=O)([O-])=O)O)5))=C6))

InChI:

1S/C27H33N9O15P2/c1-10-3-12-13(4-11(10)2)35(24-18(32-12)25(42)34-27(43)33-24)5-14(37)19(39)15(38)6-48-52(44,45)51-53(46,47)49-7-16-20(40)21(41)26(50-16)36-9-31-17-22(28)29-8-30-23(17)36/h3-4,8-9,14-16,19-21,26,37-41H,5-7H2,1-2H3,(H5,28,29,30,34,42,43,44,45,46,47)/p-3/t14-,15+,16+,19-,20+,21+,26+/m0/s1

InChIKey:

IMGVNJNCCGXBHD-UYBVJOGSSA-K

Synonyms

flavin adenine dinucleotide oxidized
flavin adenine dinucleotide
flavitan

Databases

MetaCyc: FAD

BiGG: fad

ChEBI: 57692 16238

PubChem (CID): 46906035

Wikipedia: Flavin_adenine_dinucleotide

HMDB: HMDB01248

ChemSpider: 13082029

KEGG: C00016

CAS: 146-14-5

PupChem (SID): 3318

CHEMBL: CHEMBL1232653

PDB-CCD: FAD FAE

NIKKAJI: J39.053D

Seed: cpd00015

MetaNetX: MNXM33

KNApSAcK: C00001500