Mesaconitine
Molecular Formula:
C33H45NO11
InChI: InChI=1/C33H45NO11/c1-16(35)45-33-21-18(13-31(39,28(43-6)26(33)37)27(21)44-29(38)17-10-8-7-9-11-17)32-20(41-4)12-19(36)30(15-40-3)14-34(2)25(32)22(33)23(42-5)24(30)32/h7-11,18-28,36-37,39H,12-15H2,1-6H3/t18-,19?,20?,21-,22u,23?,24-,25-,26?,27?,28+,30u,31-,32u,33-/m1/s1
InChIKey: InChIKey=XUHJBXVYNBQQBD-MIICQABABN
SMILES: CC(=O)OC12C3C(CC(C3OC(=O)C4=CC=CC=C4)(C(C1O)OC)O)C56C(CC(C7(C5C(C2C6N(C7)C)OC)COC)O)OC
Names:
Aconitane-3,8,13,14,15-pentol, 1,6,16-trimethoxy-4-(methoxymethyl)-20-methyl-, 8-acetate 14-benzoate, (1alpha,3alpha,6alpha,14alpha,15alpha,16beta)-
ACONITANE-3,8,13,14,15-PENTOL, 1,6,16-TRIMETHOXY-4-(METHOXYMETHYL)-20-METHYL-, 8
EINECS 220-397-6
Mesaconitine (8CI)
Mesaconitine
NSC 77210
2752-64-9
Registries:
PubChem CID 17679
PubChem ID 160815
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