(Q104935396)

English

methyl (1R,4aS,4bR,7R,10aS)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-, methyl ester

1 reference

based on heuristic

inferred from SMILES

mass

316.240230264 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Methyl isodextropimarate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (1S,4aS,4bR,7S,10aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate

1 reference

1 reference

C₂₁H₃₂O₂

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canonical SMILES

O=C(OC)C1(C)CCCC2(C)C3C(=CC(C=C)(C)CC3)CCC12

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isomeric SMILES

C=C[C@]1(C)C=C2CC[C@H]3[C@@](C)(CCC[C@@]3(C)C(=O)OC)[C@@H]2CC1

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found in taxon

Helianthus strumosus

1 reference

stated in

Ent-pimaranes, ent-kauranes, Heliangolides and other Constituents of three Helianthus species

Identifiers

InChI

InChI=1S/C21H32O2/c1-6-19(2)13-10-16-15(14-19)8-9-17-20(16,3)11-7-12-21(17,4)18(22)23-5/h6,14,16-17H,1,7-13H2,2-5H3/t16-,17+,19+,20+,21-/m1/s1

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InChIKey

BGCXKCIPDDNDEV-GZSKETOLSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BGCXKCIPDDNDEV-GZSKETOLSA-N

1 reference

(Q104935396)

methyl (1R,4aS,4bR,7R,10aS)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate

Statements

Identifiers

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