loganin

Chemical Formula:

C₁₇H₂₆O₁₀

Molecular Weight:

390.386 Daltons

Monoisotopic Mass:

390.15259705560004 Daltons

SMILES:

CC1(C(O)C[CH]3([CH]1C(OC2(OC(CO)C(O)C(O)C(O)2))OC=C(C(OC)=O)3))

InChI:

1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1

InChIKey:

AMBQHHVBBHTQBF-UOUCRYGSSA-N

Databases

MetaCyc: LOGANIN

RefMet: Loganin

PubChem (CID): 87691

MetaboLights: MTBLC15771

LIPID MAPS: LMPR0102070001

ChemSpider: 314629

ChEBI: 15771

KEGG: C01433

NCI: 606403

CAS: 18524-94-2

Seed: cpd01023

MetaNetX: MNXM1570