tanguticuline C
AlkaPlorer ID: AK010854
Synonym: None
IUPAC Name: None
Structure
SMILES: [H]/C([H])=C1C([H])([H])[C@@]2([C@@]3(O)[C@@](O)([H])C\1([H])[C@@]4(OC(C)=O)[H])C4[C@]5([H])[C@]63[C@@]7(C)[C@@](C([H])N5[C@@]7([H])C2([H])[H])(C)C([H])([H])[C@]([H])(OC(C(C)CC)=O)C6([H])[H]
InChI: InChI=1S/C28H39NO6/c1-7-13(2)23(32)35-16-9-24(5)12-29-17-11-26-8-14(3)18-20(34-15(4)30)19(26)21(29)27(10-16,25(17,24)6)28(26,33)22(18)31/h13,16-22,31,33H,3,7-12H2,1-2,4-6H3/t13?,16-,17-,18?,19?,20-,21+,22+,24-,25+,26-,27-,28-/m0/s1
InChIKey: JIKFCOXBYWDKHJ-WIAXFNIQSA-N
Reference
Diterpenoid alkaloids from the whole plant of Aconitum tanguticum (Maxim.) Stapf
data_source: manually
Source
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Properties Information
Molecule Weight: 485.6210000000004
TPSA？: 96.29999999999998
MolLogP？: 2.436799999999999
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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