3-acetyl T-2 toxin

Chemical Formula:

C₂₆H₃₆O₁₀

Molecular Weight:

508.564 Daltons

Monoisotopic Mass:

508.23084737659997 Daltons

SMILES:

CC(C)CC(=O)OC2(CC1(COC(=O)C)(C4(C(OC(C)=O)C(OC(=O)C)C(OC1C=C(C)2)C3(OC3)4)(C)))

InChI:

1S/C26H36O10/c1-13(2)8-20(30)35-18-10-25(11-31-15(4)27)19(9-14(18)3)36-23-21(33-16(5)28)22(34-17(6)29)24(25,7)26(23)12-32-26/h9,13,18-19,21-23H,8,10-12H2,1-7H3/t18-,19?,21+,22+,23?,24?,25+,26?/m0/s1

InChIKey:

NOTOVTQRFFVBSB-BLURLISNSA-N

Synonyms

acetyl T-2
3-acetyl T-2

Databases

MetaCyc: CPD-18415

PubChem (CID): 102515027

ChemSpider: 2299175

MetaNetX: MNXM164209