shikonin
Chemical Formula:
C16H16O5
Molecular Weight:
288.299 Daltons
Monoisotopic Mass:
288.0997736241 Daltons
SMILES:
CC(C)=CCC(C2(=CC(C1(C(=CC=C(C=1C2=O)O)O))=O))O
InChI:
1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3
InChIKey:
Databases
MetaCyc:
CPD-9322
HMDB:
HMDB30579
ChemSpider:
5019
ChEBI:
140320
PubChem (CID):
5208
KEGG:
C10292
Seed:
cpd17543
MetaNetX:
MNXM12935