tellimagrandin II

Chemical Formula:

C₄₁H₃₀O₂₆

Molecular Weight:

938.672 Daltons

Monoisotopic Mass:

938.1025311376 Daltons

SMILES:

C1(OC(=O)C7(=C(C6(=C(O)C(=C(C=C(C(=O)OC5(C1OC(OC(C2(C=C(O)C(O)=C(O)C=2))=O)C(OC(=O)C3(C=C(O)C(O)=C(O)C=3))C(OC(=O)C4(C=C(O)C(O)=C(O)C=4))5))6)O)O))C(O)=C(O)C(O)=C7))

InChI:

1S/C41H30O26/c42-15-1-10(2-16(43)26(15)50)36(57)65-34-33-23(9-62-39(60)13-7-21(48)29(53)31(55)24(13)25-14(40(61)64-33)8-22(49)30(54)32(25)56)63-41(67-38(59)12-5-19(46)28(52)20(47)6-12)35(34)66-37(58)11-3-17(44)27(51)18(45)4-11/h1-8,23,33-35,41-56H,9H2/t23-,33-,34+,35-,41+/m1/s1

InChIKey:

JCGHAEBIBSEQAD-UUUCSUBKSA-N

Synonyms

cornustannin 2
eugeniin

Databases

MetaCyc: CPD-8949

MetaboLights: MTBLC4916

HMDB: HMDB39265

ChEBI: 4916

ChemSpider: 391036

PubChem (CID): 442679

KEGG: C10224

Seed: cpd07113

MetaNetX: MNXM12983