(Q105300348)

English

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

1 reference

based on heuristic

inferred from SMILES

mass

404.219888744 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₃₂O₆

0 references

canonical SMILES

O=C1OCC=C1CCC2C(=C)CCC3C(C(=O)OC)(C)CCCC23COC(=O)C

0 references

isomeric SMILES

C=C1CC[C@H]2[C@@](C)(C(=O)OC)CCC[C@]2(COC(C)=O)[C@H]1CCC1=CCOC1=O

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found in taxon

Sciadopitys verticillata

1 reference

stated in

Diterpenes from the seed of Sciadopitys verticillata

Identifiers

InChI

InChI=1S/C23H32O6/c1-15-6-9-19-22(3,21(26)27-4)11-5-12-23(19,14-29-16(2)24)18(15)8-7-17-10-13-28-20(17)25/h10,18-19H,1,5-9,11-14H2,2-4H3/t18-,19-,22-,23-/m0/s1

0 references

InChIKey

WAOFSTKMJKTVNJ-ZZTDLJEGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WAOFSTKMJKTVNJ-ZZTDLJEGSA-N

(Q105300348)

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

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Identifiers

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