Feedback

Medicarpin 3-O-glucoside-6'-malonate

PropertiesImageOccurences in reactions
MNX_IDMNXM5351Image of MNXM5351
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
formulaC25H26O12
charge0
mass518.14243
referencechebi:80391
InChIKeyBQAJKXKYTQTBDK-PCHDOLKHSA-N
InChIInChI=1S/C25H26O12/c1-32-11-2-4-13-15-9-33-16-7-12(3-5-14(16)24(15)36-17(13)6-11)35-25-23(31)22(30)21(29)18(37-25)10-34-20(28)8-19(26)27/h2-7,15,18,21-25,29-31H,8-10H2,1H3,(H,26,27)/t15-,18+,21+,22-,23+,24-,25+/m0/s1
SMILESCOc1ccc2c(c1)O[C@H]1c3ccc(O[C@@H]4O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]4O)cc3OC[C@@H]21
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:80391
chebi:80391
kegg.compound:C16224
keggC:C16224
Medicarpin 3-O-glucoside-6'-malonate
metacyc.compound:CPD-4123
metacycM:CPD-4123
(-)-medicarpin-3-O-glucoside-6''-malonate
seed.compound:cpd14943
seedM:cpd14943
Medicarpin 3-O-glucoside-6'-malonate
(-)-medicarpin-3-O-glucoside-6''-malonate
keggC:M_C16224
seedM:M_cpd14943
secondary/obsolete/fantasy identifier