(Q105161309)

English

(1S,8abeta)-1alpha,4aalpha-Dimethyl-1-[[(2S)-2alpha-(1,3-benzodioxole-5-yl)-4beta-(1,3-benzodioxole-5-ylmethyl)tetrahydrofuran-3beta-yl]methoxy]-7alpha-(1-hydroxy-1-methylethyl)decahydronaphthalene

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2-[8-[[2-(1,3-Benzodioxol-5-yl)-4-(1,3-benzodioxol-5-ylmethyl)oxolan-3-yl]methoxy]-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]propan-2-ol

1 reference

based on heuristic

inferred from SMILES

mass

578.324353812 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₅H₄₆O₇

0 references

canonical SMILES

OC(C)(C)C1CCC2(C)CCCC(OCC3C(OCC3CC4=CC=C5OCOC5=C4)C6=CC=C7OCOC7=C6)(C)C2C1

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isomeric SMILES

CC(C)(O)[C@H]1CC[C@]2(C)CCC[C@](C)(OC[C@@H]3[C@@H](c4ccc5c(c4)OCO5)OC[C@@H]3Cc3ccc4c(c3)OCO4)[C@H]2C1

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found in taxon

Chamaecyparis obtusa

1 reference

stated in

Neurite outgrowth-promoting active constituents of the Japanese cypress (Chamaecyparis obtusa).

Identifiers

InChI

InChI=1S/C35H46O7/c1-33(2,36)25-10-13-34(3)11-5-12-35(4,31(34)17-25)42-19-26-24(14-22-6-8-27-29(15-22)40-20-38-27)18-37-32(26)23-7-9-28-30(16-23)41-21-39-28/h6-9,15-16,24-26,31-32,36H,5,10-14,17-21H2,1-4H3/t24-,25-,26-,31-,32+,34-,35-/m0/s1

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InChIKey

MCNBQWJKHHPKBD-ONPJRHEZSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MCNBQWJKHHPKBD-ONPJRHEZSA-N

1 reference

(Q105161309)

(1S,8abeta)-1alpha,4aalpha-Dimethyl-1-[[(2S)-2alpha-(1,3-benzodioxole-5-yl)-4beta-(1,3-benzodioxole-5-ylmethyl)tetrahydrofuran-3beta-yl]methoxy]-7alpha-(1-hydroxy-1-methylethyl)decahydronaphthalene

Statements

Identifiers

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