(Q105297879)

English

(12S,26S)-4,5,17,31-tetramethoxy-11,27-dimethyl-2,19,33,35-tetraoxa-11,27-diazaoctacyclo[24.10.1.114,18.120,24.03,8.07,12.030,37.032,36]nonatriaconta-1(36),3(8),4,6,14(39),15,17,20,22,24(38),30(37),31-dodecaene

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

alkaloid

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mass

666.294116304 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₉H₄₂N₂O₈

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canonical SMILES

O1C2=CC=CC(=C2)CC3C4=C(OC=5C(OC)=C(OC)C=C6C5CCN(C)C6CC7=CC=C(OC)C1=C7)C=8OCOC8C(OC)=C4CCN3C

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isomeric SMILES

COc1ccc2cc1Oc1cccc(c1)C[C@H]1c3c(c(OC)c4c(c3Oc3c5c(cc(OC)c3OC)[C@H](C2)N(C)CC5)OCO4)CCN1C

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found in taxon

Thalictrum faberi

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stated in

New dimeric aporphine-benzylisoquinoline alkaloids from Thalictrum faberi

Thalictrum foetidum

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stated in

Alkaloids of Thalictrum foetidum

Identifiers

InChI

InChI=1S/C39H42N2O8/c1-40-14-12-25-27-20-32(43-4)36(45-6)35(25)49-37-33-26(34(44-5)38-39(37)47-21-46-38)13-15-41(2)29(33)18-22-8-7-9-24(16-22)48-31-19-23(17-28(27)40)10-11-30(31)42-3/h7-11,16,19-20,28-29H,12-15,17-18,21H2,1-6H3/t28-,29-/m0/s1

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InChIKey

VVTMSPVWECSHQM-VMPREFPWSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

VVTMSPVWECSHQM-VMPREFPWSA-N

1 reference

(Q105297879)

(12S,26S)-4,5,17,31-tetramethoxy-11,27-dimethyl-2,19,33,35-tetraoxa-11,27-diazaoctacyclo[24.10.1.114,18.120,24.03,8.07,12.030,37.032,36]nonatriaconta-1(36),3(8),4,6,14(39),15,17,20,22,24(38),30(37),31-dodecaene

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Identifiers

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