gypsogenin-28-beta-D-glucoside
Chemical Formula:
C36H56O9
Molecular Weight:
632.833 Daltons
Monoisotopic Mass:
632.3924333965 Daltons
SMILES:
CC5(CCC4(CCC1(C(=CCC2(C1(CCC3(C2(CCC(C3(C)C=O)O)C))C))C4C5)C)C(=O)OC6(C(C(C(C(CO)O6)O)O)O))C
InChI:
1S/C36H56O9/c1-31(2)13-15-36(30(43)45-29-28(42)27(41)26(40)22(18-37)44-29)16-14-34(5)20(21(36)17-31)7-8-24-32(3)11-10-25(39)33(4,19-38)23(32)9-12-35(24,34)6/h7,19,21-29,37,39-42H,8-18H2,1-6H3/t21?,22?,23?,24?,25-,26+,27-,28-,29?,32-,33-,34+,35+,36-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-9472
PubChem (CID):
25245926
Seed:
cpd25695
MetaNetX:
MNXM18296