(Q105004846)

English

methyl (1S,4aS,5S,8aR)-4a-(acetyloxymethyl)-5-[2-(furan-3-yl)-2-oxoethyl]-1-methyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

methyl 4a-(acetyloxymethyl)-5-[2-(furan-3-yl)-2-oxoethyl]-1-methyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

402.20423868 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₀O₆

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canonical SMILES

O=C(OCC12CCCC(C(=O)OC)(C)C2CCC(=C)C1CC(=O)C3=COC=C3)C

0 references

isomeric SMILES

C=C1CC[C@H]2[C@@](C)(C(=O)OC)CCC[C@]2(COC(C)=O)[C@H]1CC(=O)c1ccoc1

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found in taxon

Sciadopitys verticillata

1 reference

stated in

Diterpenes from the seed of Sciadopitys verticillata

Identifiers

InChI

InChI=1S/C23H30O6/c1-15-6-7-20-22(3,21(26)27-4)9-5-10-23(20,14-29-16(2)24)18(15)12-19(25)17-8-11-28-13-17/h8,11,13,18,20H,1,5-7,9-10,12,14H2,2-4H3/t18-,20-,22-,23-/m0/s1

0 references

InChIKey

FZBHSCLJFMTBCI-HMNCIZAVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FZBHSCLJFMTBCI-HMNCIZAVSA-N

(Q105004846)

methyl (1S,4aS,5S,8aR)-4a-(acetyloxymethyl)-5-[2-(furan-3-yl)-2-oxoethyl]-1-methyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

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