MF: C64H115NO5
MW: 978.6g/mol
IUPAC Name: 1-O-[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 5-O-(2-octyldodecyl) (2S)-2-(dodecanoylamino)pentanedioate
Isomeric SMILES: CCCCCCCCCCCC(=O)N[C@@H](CCC(=O)OCC(CCCCCCCC)CCCCCCCCCC)C(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C
InChIKey: NMMPOVJVXNXRRN-IRUJCTRMSA-N
InChI: InChI=1S/C64H115NO5/c1-9-12-15-18-21-23-25-28-31-37-60(66)65-59(42-43-61(67)69-49-52(35-29-26-20-17-14-11-3)36-30-27-24-22-19-16-13-10-2)62(68)70-54-44-46-63(7)53(48-54)38-39-55-57-41-40-56(51(6)34-32-33-50(4)5)64(57,8)47-45-58(55)63/h38,50-52,54-59H,9-37,39-49H2,1-8H3,(H,65,66)/t51-,52?,54+,55+,56-,57+,58+,59+,63+,64-/m1/s1
