(Q105009099)

English

[(3aR,4S,5aR,6S,8S,9S,9aS,9bS)-4,8-dihydroxy-5a-methyl-3-methylidene-2-oxospiro[3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-9,2'-oxirane]-6-yl] 2-methylprop-2-enoate

chemical compound

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instance of

type of chemical entity

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subclass of

(4,8-Dihydroxy-5a-methyl-3-methylidene-2-oxospiro[3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-9,2'-oxirane]-6-yl) 2-methylprop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

364.152203108 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₄O₇

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canonical SMILES

O=C(OC1CC(O)C2(OC2)C3C4OC(=O)C(=C)C4C(O)CC13C)C(=C)C

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isomeric SMILES

C=C(C)C(=O)O[C@H]1C[C@H](O)[C@@]2(CO2)[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](O)C[C@@]12C

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found in taxon

Dimerostemma brasilianum

1 reference

stated in

Eudesmanolides from Dimerostemma brasilianum

Identifiers

InChI

InChI=1S/C19H24O7/c1-8(2)16(22)25-12-5-11(21)19(7-24-19)15-14-13(9(3)17(23)26-14)10(20)6-18(12,15)4/h10-15,20-21H,1,3,5-7H2,2,4H3/t10-,11-,12-,13+,14-,15+,18-,19-/m0/s1

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InChIKey

GIMYBLKMNDJWEJ-CWWDRAIYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GIMYBLKMNDJWEJ-CWWDRAIYSA-N

(Q105009099)

[(3aR,4S,5aR,6S,8S,9S,9aS,9bS)-4,8-dihydroxy-5a-methyl-3-methylidene-2-oxospiro[3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-9,2'-oxirane]-6-yl] 2-methylprop-2-enoate

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