(Q105226417)

English

1-[(4aR,5R,7S,8aS)-5-[[(1R,2S,5R,9S,11R,13S,17R)-2-hydroxy-11,14-dimethyl-6,14-diazatetracyclo[7.6.2.02,7.013,17]heptadec-6-en-5-yl]methyl]-7-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]ethanone

chemical compound

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instance of

type of chemical entity

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subclass of

1-[5-[(2-hydroxy-11,14-dimethyl-6,14-diazatetracyclo[7.6.2.02,7.013,17]heptadec-6-en-5-yl)methyl]-7-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]ethanone

1 reference

based on heuristic

inferred from SMILES

mass

483.382477808 dalton

1 reference

2 references

inferred from InChIKey

1 reference

C₃₀H₄₉N₃O₂

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canonical SMILES

O=C(N1CCCC2C1CC(C)CC2CC3N=C4CC5CC(C)CC6N(C)CC(CC65)C4(O)CC3)C

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isomeric SMILES

CC(=O)N1CCC[C@H]2[C@@H]1C[C@@H](C)C[C@@H]2C[C@H]1CC[C@@]2(O)C(=N1)C[C@@H]1C[C@@H](C)C[C@H]3[C@@H]1C[C@@H]2CN3C

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found in taxon

Huperzia lucidula

1 reference

stated in

A new type of Lycopodium alkaloid. The C30N3 alkaloids from Lycopodium lucidulum

Identifiers

InChI

InChI=1S/C30H49N3O2/c1-18-11-22-15-29-30(35,23-16-26(22)27(12-18)32(4)17-23)8-7-24(31-29)14-21-10-19(2)13-28-25(21)6-5-9-33(28)20(3)34/h18-19,21-28,35H,5-17H2,1-4H3/t18-,19+,21-,22+,23-,24-,25-,26-,27+,28+,30+/m1/s1

0 references

InChIKey

QRIZONDFXOOWTA-UZGZOUGJSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QRIZONDFXOOWTA-UZGZOUGJSA-N

1 reference

(Q105226417)

1-[(4aR,5R,7S,8aS)-5-[[(1R,2S,5R,9S,11R,13S,17R)-2-hydroxy-11,14-dimethyl-6,14-diazatetracyclo[7.6.2.02,7.013,17]heptadec-6-en-5-yl]methyl]-7-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]ethanone

Statements

Identifiers

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