| 2D Structure | |
| CID | 101663368 |
| IUPAC Name | (1R,2R,5R,7S,10R,11R,14R,18R)-1,2,6,6,10-pentamethyl-18-(3-methylbut-2-enyl)-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-17,21-dioxapentacyclo[12.8.0.02,11.05,10.015,19]docos-15(19)-ene-16,22-dione |
| InChI | InChI=1S/C42H64O14/c1-19(2)9-11-23-21-17-52-38(50)42(8)22(28(21)35(49)54-23)10-12-26-40(6)15-14-27(39(4,5)25(40)13-16-41(26,42)7)56-37-34(48)32(46)30(44)24(55-37)18-51-36-33(47)31(45)29(43)20(3)53-36/h9,20,22-27,29-34,36-37,43-48H,10-18H2,1-8H3/t20-,22+,23+,24+,25-,26+,27-,29-,30+,31+,32-,33+,34+,36+,37-,40-,41+,42-/m0/s1 |
| InChI Key | MRRXLUATSGZGMZ-UBNBOHLQSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C42H64O14 |
| Molecular Weight | 792.9 |
| synonyms | ['Mabioside C', 'CHEBI:176320', '(1R,2R,5R,7S,10R,11R,14R,18R)-1,2,6,6,10-pentamethyl-18-(3-methylbut-2-enyl)-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-17,21-dioxapentacyclo[12.8.0.02,11.05,10.015,19]docos-15(19)-ene-16,22-dione'] |
From Pubchem