(Q105382381)

English

(2S,3R,6R)-6-[10-[8-[10-[(2R,5R,6S)-5-hydroxy-6-methylpiperidin-2-yl]decyl]-2,3-dihydro-1H-indolizin-4-ium-6-yl]decyl]-2-methylpiperidin-3-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

piperidine alkaloids

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indolizidine alkaloid

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mass

626.56190496409 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(2S,3R,6R)-6-[10-[8-[10-[(2R,5S,6R)-5-hydroxy-6-methylpiperidin-2-yl]decyl]-2,3-dihydro-1H-indolizin-4-ium-6-yl]decyl]-2-methylpiperidin-3-ol

1 reference

based on heuristic

inferred from InChI

(2R,3R,6S)-6-[10-[8-[10-[(2R,5R,6S)-5-hydroxy-6-methylpiperidin-2-yl]decyl]-2,3-dihydro-1H-indolizin-4-ium-6-yl]decyl]-2-methylpiperidin-3-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₀H₇₂N₃O₂⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

OC1CCC(NC1C)CCCCCCCCCCC=2C=C(C3=[N+](C2)CCC3)CCCCCCCCCCC4NC(C)C(O)CC4

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isomeric SMILES

C[C@@H]1N[C@H](CCCCCCCCCCc2cc(CCCCCCCCCC[C@@H]3CC[C@@H](O)[C@H](C)N3)c3[n+](c2)CCC3)CC[C@H]1O

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found in taxon

Prosopis glandulosa

1 reference

stated in

Indolizidine, antiinfective and antiparasitic compounds from Prosopis glandulosa var. glandulosa

Identifiers

InChI

InChI=1S/C40H72N3O2/c1-32-39(44)27-25-36(41-32)22-17-13-9-5-3-7-11-15-20-34-30-35(38-24-19-29-43(38)31-34)21-16-12-8-4-6-10-14-18-23-37-26-28-40(45)33(2)42-37/h30-33,36-37,39-42,44-45H,3-29H2,1-2H3/q+1/t32-,33-,36+,37+,39+,40+/m0/s1

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InChIKey

ZSATVXRUAGIIJL-KQRUAAFTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZSATVXRUAGIIJL-KQRUAAFTSA-N

1 reference

(Q105382381)

(2S,3R,6R)-6-[10-[8-[10-[(2R,5R,6S)-5-hydroxy-6-methylpiperidin-2-yl]decyl]-2,3-dihydro-1H-indolizin-4-ium-6-yl]decyl]-2-methylpiperidin-3-ol

Statements

Identifiers

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