GHS
GHS Classification Search
[(1S,2S,6R,10S,11R,13S,14R,15R)-13-acetyloxy-1,6-dihydroxy-4,12,12,15-tetramethyl-5-oxo-8-(trityloxymethyl)-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] acetate
CAS Number: 77495-83-1
IUPAC name: [(1S,2S,6R,10S,11R,13S,14R,15R)-13-acetyloxy-1,6-dihydroxy-4,12,12,15-tetramethyl-5-oxo-8-(trityloxymethyl)-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] acetate
Molecular formula: C43H46O8
Molecular weight: 690.8
InChI: InChI=1S/C43H46O8/c1-26-22-35-40(47,37(26)46)24-30(23-34-36-39(5,6)43(36,51-29(4)45)38(50-28(3)44)27(2)41(34,35)48)25-49-42(31-16-10-7-11-17-31,32-18-12-8-13-19-32)33-20-14-9-15-21-33/h7-23,27,34-36,38,47-48H,24-25H2,1-6H3/t27-,34+,35-,36-,38-,40-,41-,43-/m1/s1
InChIKey: NAPDZLDFJSOVFY-GCXXDTTESA-N
SMILES: C[C@@H]1[C@H]([C@@]2([C@@H](C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)COC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)O)C)O)OC(=O)C)OC(=O)C
EINECS: -
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