17-(4-hydroxyphenyl)heptadecanoyl adenylate
Chemical Formula:
C33H49N5O9P
Molecular Weight:
690.752 Daltons
Monoisotopic Mass:
691.3346147399001 Daltons
SMILES:
C(C3(C(C(C(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O)O))OP(OC(=O)CCCCCCCCCCCCCCCCC4(=CC=C(O)C=C4))([O-])=O
InChI:
1S/C33H50N5O9P/c34-31-28-32(36-22-35-31)38(23-37-28)33-30(42)29(41)26(46-33)21-45-48(43,44)47-27(40)16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-24-17-19-25(39)20-18-24/h17-20,22-23,26,29-30,33,39,41-42H,1-16,21H2,(H,43,44)(H2,34,35,36)/p-1/t26-,29-,30-,33-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-18624
ChEBI:
91234
PubChem (CID):
102515501
MetaNetX:
MNXM162732
KEGG:
C21445