(Q105217529)

English

methyl 2-[(1aS,2'S,2aS,6aS,7S,7aS)-2',3,3,6a,7a-pentamethylspiro[1a,2,2a,4,5,6-hexahydronaphtho[2,3-b]oxirene-7,5'-oxolane]-2'-yl]acetate

chemical compound

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instance of

type of chemical entity

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subclass of

Methyl 2-(2',3,3,6a,7a-pentamethylspiro[1a,2,2a,4,5,6-hexahydronaphtho[2,3-b]oxirene-7,5'-oxolane]-2'-yl)acetate

1 reference

based on heuristic

inferred from SMILES

mass

350.245709568 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl 2-[(1aS,2'R,2aR,6aS,7S,7aS)-2',3,3,6a,7a-pentamethylspiro[1a,2,2a,4,5,6-hexahydronaphtho[2,3-b]oxirene-7,5'-oxolane]-2'-yl]acetate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₄O₄

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canonical SMILES

O=C(OC)CC1(OC2(CC1)C3(OC3CC4C(C)(C)CCCC42C)C)C

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isomeric SMILES

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

0 references

1 reference

1 reference

1 reference

Identifiers

InChI

InChI=1S/C21H34O4/c1-17(2)8-7-9-19(4)14(17)12-15-20(5,24-15)21(19)11-10-18(3,25-21)13-16(22)23-6/h14-15H,7-13H2,1-6H3/t14-,15-,18-,19-,20-,21-/m0/s1

0 references

InChIKey

QANDVVHKFKLLCQ-XRYUJSLGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QANDVVHKFKLLCQ-XRYUJSLGSA-N

(Q105217529)

methyl 2-[(1aS,2'S,2aS,6aS,7S,7aS)-2',3,3,6a,7a-pentamethylspiro[1a,2,2a,4,5,6-hexahydronaphtho[2,3-b]oxirene-7,5'-oxolane]-2'-yl]acetate

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