(Q105224267)

English

methyl (1S,4aR,4bS,7S,10aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

methyl 7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

316.240230264 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Methyl pimara-7,15-dien-18-oate

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

methyl (1R,4aS,4bR,7S,10aS)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₃₂O₂

0 references

canonical SMILES

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

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isomeric SMILES

C=C[C@@]1(C)CC[C@H]2C(=CC[C@H]3[C@@](C)(C(=O)OC)CCC[C@]23C)C1

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found in taxon

Fritillaria thunbergii

1 reference

stated in

Studies on the constituents of the crude drug "Fritillariae bulbus." III. On the diterpenoid constituents of fresh bulbs of Fritillaria thunbergii Miq.

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/h6,8,16-17H,1,7,9-14H2,2-5H3/t16-,17+,19-,20+,21-/m0/s1

0 references

InChIKey

QMZKBAQNFAMESG-NXIXHYNASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QMZKBAQNFAMESG-NXIXHYNASA-N

1 reference

(Q105224267)

methyl (1S,4aR,4bS,7S,10aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylate

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Identifiers

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