kievitone hydrate

Chemical Formula:

C₂₀H₂₂O₇

Molecular Weight:

374.39 Daltons

Monoisotopic Mass:

374.1365530609 Daltons

SMILES:

CC(C)(O)CCC3(C(O)=CC(O)=C2(C(OCC(C1(=CC=C(C=C(O)1)O))C(=O)2)=3))

InChI:

1S/C20H22O7/c1-20(2,26)6-5-12-15(23)8-16(24)17-18(25)13(9-27-19(12)17)11-4-3-10(21)7-14(11)22/h3-4,7-8,13,21-24,26H,5-6,9H2,1-2H3

InChIKey:

QISUKJAAXYVLMA-UHFFFAOYSA-N

Databases

MetaCyc: CPD-34

MetaboLights: MTBLC17529

HMDB: HMDB38111

ChemSpider: 163792

PubChem (CID): 188458

ChEBI: 17529

KEGG: C02549

CAS: 62682-11-5

RefMet: Kievitone hydrate

Seed: cpd01673

MetaNetX: MNXM4630