$450.00
| CAS No.: | 93772-68-0 |
| Molecular Formula | C₃₃H₄₇NO₁₀ |
| Molecular Weight | 617.7g/mol |
| Purity | HPLC>98% |
| Chemical Family | Alkaloids |
| Weight |
|---|
IUPAC Name: [(1S,2R,3R,4R,5S,6S,7S,8R,9S,10R,13R,14R,16S,17S,18R)-11-ethyl-5,7,14-trihydroxy-6,8,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
InChI: InChI=1S/C33H47NO10/c1-7-34-15-30(16-39-2)19(35)13-20(40-3)32-18-14-31(38)27(44-29(37)17-11-9-8-10-12-17)21(18)33(43-6,26(36)28(31)42-5)22(25(32)34)23(41-4)24(30)32/h8-12,18-28,35-36,38H,7,13-16H2,1-6H3/t18-,19-,20+,21-,22-,23+,24-,25-,26+,27-,28+,30+,31+,32+,33-/m1/s1
InChIKey: VEMVATSAPLNYSX-OMKGQGRNSA-N
Canonical SMILES: CCN1CC2(C(CC(C34C2C(C(C31)C5(C6C4CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)OC)OC)OC)O)COC
Isomeric SMILES: CCN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@H]([C@H]31)[C@@]5([C@@H]6[C@H]4C[C@]([C@@H]6OC(=O)C7=CC=CC=C7)([C@H]([C@@H]5O)OC)O)OC)OC)OC)O)COC
Synonyms: 93772-68-0; 14-Benzoyl-8-O-methylaconine; AKOS040763175; DA-59864
Botanical Source:
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