protoaphin aglucone
Chemical Formula:
C30H27O11
Molecular Weight:
563.537 Daltons
Monoisotopic Mass:
564.1631617419 Daltons
SMILES:
CC5(OC(C)C(O)C4(=C(C1(=C([O-])C=C(O)C2(C(=O)C3(=C(C(=O)C1=2)C(O)C(C)OC(C)3))))C6(C=C(O)C=C(O)C(C(O)=C45)=6)))
InChI:
1S/C30H28O11/c1-8-17-23(26(35)10(3)40-8)20(13-5-12(31)6-14(32)19(13)28(17)37)21-15(33)7-16(34)22-24(21)30(39)25-18(29(22)38)9(2)41-11(4)27(25)36/h5-11,26-27,31-37H,1-4H3/p-1
InChIKey:
Databases
MetaCyc:
PROTOAPHIN-AGLUCONE
ChEBI:
15795
PubChem (CID):
25203668
KEGG:
C02879
Seed:
cpd12211
MetaNetX:
MNXM4793