(Q105220742)

English

1-[(8S,21S)-13-hydroxy-16,27-dimethoxy-22-methyl-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.14,30.110,14.115,19.03,8.025,33.028,32]hexatriaconta-1(30),2,4(34),10(36),11,13,15,17,19(35),25,27,32-dodecaen-7-yl]ethanone

chemical compound

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instance of

type of chemical entity

0 references

subclass of

1-{13-hydroxy-16,27-dimethoxy-22-methyl-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.1⁴,³⁰.1¹⁰,¹⁴.1¹⁵,¹⁹.0³,⁸.0²⁵,³³.0²⁸,³²]hexatriaconta-1(30),2,4(34),10,12,14(36),15(35),16,18,25,27,32-dodecaen-7-yl}ethanone

1 reference

based on heuristic

inferred from SMILES

mass

604.257336872 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

1-[(8R,21R)-13-hydroxy-16,27-dimethoxy-22-methyl-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.14,30.110,14.115,19.03,8.025,33.028,32]hexatriaconta-1(30),2,4(34),10(36),11,13,15,17,19(35),25,27,32-dodecaen-7-yl]ethanone

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₇H₃₆N₂O₆

0 references

canonical SMILES

O=C(N1CCC2=CC=3OC4=C(OC)C=C5C6=C4OC3C=C2C1CC=7C=CC(O)=C(C7)C8=CC(=CC=C8OC)CC6N(C)CC5)C

0 references

isomeric SMILES

COc1ccc2cc1-c1cc(ccc1O)C[C@H]1c3cc4c(cc3CCN1C(C)=O)Oc1c(OC)cc3c(c1O4)[C@H](C2)N(C)CC3

0 references

found in taxon

Tiliacora acuminata

1 reference

stated in

Structure of tiliamosine: A new diphenyl bisbenzylisoquinoline alkaloid from tiliacora racemosa

Identifiers

InChI

InChI=1S/C37H36N2O6/c1-20(40)39-12-10-23-17-32-33-19-25(23)28(39)15-21-5-7-30(41)26(13-21)27-14-22(6-8-31(27)42-3)16-29-35-24(9-11-38(29)2)18-34(43-4)36(44-32)37(35)45-33/h5-8,13-14,17-19,28-29,41H,9-12,15-16H2,1-4H3/t28-,29-/m0/s1

0 references

InChIKey

QGWNPKUGFXPLRB-VMPREFPWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QGWNPKUGFXPLRB-VMPREFPWSA-N

(Q105220742)

1-[(8S,21S)-13-hydroxy-16,27-dimethoxy-22-methyl-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.14,30.110,14.115,19.03,8.025,33.028,32]hexatriaconta-1(30),2,4(34),10(36),11,13,15,17,19(35),25,27,32-dodecaen-7-yl]ethanone

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