(Q104911305)

English

(13aR)-12-[[(6aR)-1,2,3,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy]-2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline

chemical compound

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instance of

type of chemical entity

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subclass of

2,3,10,11-tetramethoxy-12-[(1,2,3,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl)oxy]-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline

1 reference

based on heuristic

inferred from SMILES

mass

724.335981116 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(13aR)-12-[[(6aS)-1,2,3,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy]-2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₄₂H₄₈N₂O₉

0 references

canonical SMILES

O(C=1C=C2C(=CC1OC)C=3C(OC)=C(OC)C(OC)=C4C3C(N(C)CC4)C2)C=5C(OC)=C(OC)C=C6C5CC7C8=CC(OC)=C(OC)C=C8CCN7C6

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isomeric SMILES

COc1cc2c(cc1OC)[C@H]1Cc3c(cc(OC)c(OC)c3Oc3cc4c(cc3OC)-c3c(OC)c(OC)c(OC)c5c3[C@@H](C4)N(C)CC5)CN1CC2

0 references

found in taxon

Thalictrum wangii

1 reference

stated in

Thalibealine, a novel tetrahydroprotoberberine--aporphine dimeric alkaloid from Thalictrum wangii

Identifiers

InChI

InChI=1S/C42H48N2O9/c1-43-12-11-25-36-30(43)14-23-16-34(33(47-4)20-27(23)37(36)41(51-8)42(52-9)38(25)49-6)53-39-28-18-29-26-19-32(46-3)31(45-2)15-22(26)10-13-44(29)21-24(28)17-35(48-5)40(39)50-7/h15-17,19-20,29-30H,10-14,18,21H2,1-9H3/t29-,30-/m1/s1

0 references

InChIKey

AFLFUXQTWZZMDX-LOYHVIPDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AFLFUXQTWZZMDX-LOYHVIPDSA-N

(Q104911305)

(13aR)-12-[[(6aR)-1,2,3,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy]-2,3,10,11-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline

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