10-OH-Aconitine
Molecular Formula:
C34H47NO12
InChI: InChI=1/C34H47NO12/c1-7-35-15-30(16-42-3)19(37)13-20(43-4)33-23(30)22(44-5)21(25(33)35)34(47-17(2)36)24-27(46-29(39)18-11-9-8-10-12-18)31(40,14-32(24,33)41)28(45-6)26(34)38/h8-12,19-28,37-38,40-41H,7,13-16H2,1-6H3/t19-,20+,21+,22+,23?,24?,25?,26+,27?,28+,30+,31?,32u,33-,34+/m1/s1
InChIKey: InChIKey=GMSKTJVHWUUOMY-OMZXGYBGBX
SMILES: CCN1CC2(C(CC(C34C2C(C(C31)C5(C6C4(CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)O)OC(=O)C)OC)OC)O)COC
Names:
10-OH-Aconitine
Registries:
PubChem CID 6426873
PubChem ID 10486858
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