Datiscoside
Molecular Formula:
C38H54O12
InChI: InChI=1/C38H54O12/c1-18-27(43)28(44)29(49-19(2)39)32(48-18)50-23-16-35(7)24-12-11-20-21(15-22(40)31(45)34(20,5)6)37(24,9)26(42)17-36(35,8)30(23)38(10,47)25(41)13-14-33(3,4)46/h11,13-14,18,21-24,27,29-30,32,40,43,46-47H,12,15-17H2,1-10H3/b14-13+
InChIKey: InChIKey=RRPAPBCRZGEXTR-BUHFOSPRBX
SMILES: CC1C(C(=O)C(C(O1)OC2CC3(C4CC=C5C(C4(C(=O)CC3(C2C(C)(C(=O)C=CC(C)(C)O)O)C)C)CC(C(=O)C5(C)C)O)C)OC(=O)C)O
Names:
AIDS-127108
AIDS127108
CUCURBITACIN D DEHYDROEPIRHAMNOSIDE
Datisca principle A
Datiscoside
NSC144153
17-(1,5-Dihydroxy-1,5-dimethyl-2-oxo-3-hexenyl)-2-hydroxy-4,4,9,14-tetramethyl-3,11-dioxoestr-5-en-16-yl 2-O-acetyl-6-deoxyhexopyranosid-3-ulose
36067-56-8
[2-[[17-[(E)-2,6-dihydroxy-6-methyl-3-oxo-hept-4-en-2-yl]-2-hydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-16-yl]oxy]-5-hydroxy-6-methyl-4-oxo-oxan-3-yl] acetate
Registries:
PubChem CID 5927581
PubChem ID 223057
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