delphinidin 3-O-rutinoside

delphinidin 3-<i>O</i>-rutinoside




Chemical Formula:
C27H30O16
Molecular Weight:
610.524 Daltons
Monoisotopic Mass:
611.1612099486999 Daltons
SMILES:
CC5(C(O)C(O)C(O)C(OCC1(C(O)C(O)C(O)C(O1)OC3(C(C2(C=C(O)C(O)=C(O)C=2))=[O+]C4(=C(C=3)C([O-])=CC(O)=C4))))O5)
InChI:
1S/C27H30O16/c1-8-18(32)21(35)23(37)26(40-8)39-7-17-20(34)22(36)24(38)27(43-17)42-16-6-11-12(29)4-10(28)5-15(11)41-25(16)9-2-13(30)19(33)14(31)3-9/h2-6,8,17-18,20-24,26-27,32,34-38H,7H2,1H3,(H4-,28,29,30,31,33)/t8-,17-,18-,20-,21+,22+,23+,24-,26-,27-/m1/s1
InChIKey:
PLKUTZNSKRWCCA-VRXTXMPYSA-N

Synonyms
  • delphinidin 3-rhamnoglucoside
  • tulipanin

Databases
MetaCyc:  CPD-7145
PubChem (CID):  90657596
HMDB:  HMDB38001
ChemSpider:  4590910
MetaNetX:  MNXM148202