sucrose-3-(2-methylbutyryl)-4-isovalerate

Chemical Formula:

C₂₂H₃₈O₁₃

Molecular Weight:

510.534 Daltons

Monoisotopic Mass:

510.23124130710005 Daltons

SMILES:

CCC(C)C(OC2(C(C(OC1(OC(CO)C(C(O)1)O)CO)OC(C(OC(=O)CC(C)C)2)CO)O))=O

InChI:

1S/C22H38O13/c1-5-11(4)20(30)33-18-16(28)21(31-13(8-24)17(18)32-14(26)6-10(2)3)35-22(9-25)19(29)15(27)12(7-23)34-22/h10-13,15-19,21,23-25,27-29H,5-9H2,1-4H3/t11?,12-,13-,15-,16-,17-,18-,19+,21-,22+/m1/s1

InChIKey:

BNTSBBGKFQEZMC-RCOSXJMQSA-N

Databases

MetaCyc: CPD-19025

PubChem (CID): 122706632

MetaNetX: MNXM683053