rebaudioside A

Chemical Formula:

C₄₄H₇₀O₂₃

Molecular Weight:

967.023 Daltons

Monoisotopic Mass:

966.4307885553 Daltons

SMILES:

C=C1(CC68(CC1(OC4(OC(C(O)C(OC2(C(O)C(C(O)C(CO)O2)O))C(OC3(C(O)C(CO)OC(C(O)3)O))4)CO))CC[CH](C7(C)(CCCC(C(OC5(C(O)C(C(O)C(CO)O5)O))=O)(C)[CH](CC6)7))8))

InChI:

1S/C44H70O23/c1-17-11-43-9-5-22-41(2,7-4-8-42(22,3)40(59)66-38-31(56)29(54)25(50)19(13-46)62-38)23(43)6-10-44(17,16-43)67-39-35(64-33-26(51)20(14-47)60-36(58)32(33)57)34(27(52)21(15-48)63-39)65-37-30(55)28(53)24(49)18(12-45)61-37/h18-39,45-58H,1,4-16H2,2-3H3/t18-,19-,20-,21-,22+,23+,24-,25-,26-,27-,28+,29+,30-,31-,32-,33+,34+,35-,36-,37+,38+,39+,41-,42-,43-,44+/m1/s1

InChIKey:

AEKOIHHFPRXTAD-CBHMQQJDSA-N

Synonyms

truvia
19-O-β-glucopyranosyl-13-O-(β-glucopyranosyl(1-2)-β-glucopyranosyl(1-3))-β-glucopyranosyl-13-hydroxykaur-16-en-19-oic acid

Databases

MetaCyc: CPD-14506

PubChem (CID): 90657888 135397978

CAS: 58543-16-1

HMDB: HMDB34950

MetaNetX: MNXM97603