(Q105310751)

English

methyl 2-[(2'R,4aR,8R,8aR)-7-(acetyloxymethyl)-2',4,4,8a-tetramethylspiro[2,3,4a,5-tetrahydro-1H-naphthalene-8,5'-oxolane]-2'-yl]acetate

chemical compound

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instance of

type of chemical entity

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subclass of

methyl 2-[7-(acetyloxymethyl)-2',4,4,8a-tetramethylspiro[2,3,4a,5-tetrahydro-1H-naphthalene-8,5'-oxolane]-2'-yl]acetate

1 reference

based on heuristic

inferred from SMILES

mass

392.256274252 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl 2-[(2'S,4aS,8S,8aS)-7-(acetyloxymethyl)-2',4,4,8a-tetramethylspiro[2,3,4a,5-tetrahydro-1H-naphthalene-8,5'-oxolane]-2'-yl]acetate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₃H₃₆O₅

0 references

canonical SMILES

O=C(OCC1=CCC2C(C)(C)CCCC2(C)C31OC(C)(CC(=O)OC)CC3)C

0 references

isomeric SMILES

COC(=O)C[C@@]1(C)CC[C@]2(O1)C(COC(C)=O)=CC[C@@H]1C(C)(C)CCC[C@]12C

0 references

found in taxon

Isocoma tenuisecta

1 reference

stated in

Grindelane diterpenoids from Isocoma tenuisecta

Identifiers

InChI

InChI=1S/C23H36O5/c1-16(24)27-15-17-8-9-18-20(2,3)10-7-11-22(18,5)23(17)13-12-21(4,28-23)14-19(25)26-6/h8,18H,7,9-15H2,1-6H3/t18-,21-,22-,23+/m1/s1

0 references

InChIKey

WQJABVVGZPWTBS-HWHRFOGPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

WQJABVVGZPWTBS-HWHRFOGPSA-N

(Q105310751)

methyl 2-[(2'R,4aR,8R,8aR)-7-(acetyloxymethyl)-2',4,4,8a-tetramethylspiro[2,3,4a,5-tetrahydro-1H-naphthalene-8,5'-oxolane]-2'-yl]acetate

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