(Q105167391)

English

[(8R,9S,10R,11R)-11-acetyloxy-3-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (E)-2-methylbut-2-enoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(11-Acetyloxy-3-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl) 2-methylbut-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

558.246497416 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(8R,9R,10R,11S)-11-acetyloxy-3-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (E)-2-methylbut-2-enoate

1 reference

based on heuristic

inferred from InChIKey

[(8S,9R,10S,11R)-11-acetyloxy-3-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (E)-2-methylbut-2-enoate

1 reference

1 reference

[(8R,9S,10R,11R)-11-acetyloxy-3-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (Z)-2-methylbut-2-enoate

1 reference

1 reference

C₃₀H₃₈O₁₀

0 references

canonical SMILES

O=C(OC1C=2C=C(OC)C(OC)=C(O)C2C3=C(OC)C(OC)=C(OC)C=C3C(OC(=O)C)C(C)C1C)C(=CC)C

0 references

isomeric SMILES

C/C=C(\C)C(=O)O[C@H]1c2cc(OC)c(OC)c(O)c2-c2c(cc(OC)c(OC)c2OC)[C@H](OC(C)=O)[C@H](C)[C@@H]1C

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found in taxon

Kadsura angustifolia

1 reference

stated in

Lignans from Kadsura angustifolia

Identifiers

InChI

InChI=1S/C30H38O10/c1-11-14(2)30(33)40-26-16(4)15(3)25(39-17(5)31)19-13-21(35-7)28(37-9)29(38-10)23(19)22-18(26)12-20(34-6)27(36-8)24(22)32/h11-13,15-16,25-26,32H,1-10H3/b14-11+/t15-,16+,25-,26-/m1/s1

0 references

InChIKey

MLZWZUMLLVUXMT-AOVKBNLASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MLZWZUMLLVUXMT-AOVKBNLASA-N

(Q105167391)

[(8R,9S,10R,11R)-11-acetyloxy-3-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-8-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (E)-2-methylbut-2-enoate

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