C32-carboxyphthiodiolenone

Chemical Formula:

C₃₂H₅₉O₅

Molecular Weight:

523.815 Daltons

Monoisotopic Mass:

524.4440750365001 Daltons

SMILES:

CCCCCCCCCCCCCCCCCCCC(O)CC(O)CCCC=C(C)C(=O)C(C)C([O-])=O

InChI:

1S/C32H60O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-29(33)26-30(34)25-22-21-23-27(2)31(35)28(3)32(36)37/h23,28-30,33-34H,4-22,24-26H2,1-3H3,(H,36,37)/p-1/b27-23+/t28?,29-,30-/m1/s1

InChIKey:

ICMCENBETJTZTD-HFKTZVCVSA-M

Synonyms

(4E,9R,11R)-9,11-dihydroxy-2,4-dimethyl-3-oxotriacont-4-enoate

Databases

MetaCyc: CPD-18673

PubChem (CID): 122706141

MetaNetX: MNXM164630