(Q105191552)

English

(1S,2R,4aR,4bS,8R,8aR)-2-ethenyl-8-(hydroxymethyl)-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-1-ol

chemical compound

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type of chemical entity

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subclass of

2-ethenyl-8-(hydroxymethyl)-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-1-ol

1 reference

based on heuristic

inferred from SMILES

mass

304.240230264 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₂O₂

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canonical SMILES

OCC1(C)CCCC2(C)C3C(=CCC12)C(O)C(C=C)(C)CC3

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isomeric SMILES

C=C[C@@]1(C)CC[C@H]2C(=CC[C@@H]3[C@]2(C)CCC[C@@]3(C)CO)[C@H]1O

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found in taxon

Callicarpa macrophylla

1 reference

stated in

Bioactive Diterpenoids from the Leaves of Callicarpa macrophylla

Salvia greggii

1 reference

stated in

Diterpenoids from Salvia greggii

Identifiers

InChI

InChI=1S/C20H32O2/c1-5-18(2)12-9-15-14(17(18)22)7-8-16-19(3,13-21)10-6-11-20(15,16)4/h5,7,15-17,21-22H,1,6,8-13H2,2-4H3/t15-,16-,17+,18-,19-,20+/m0/s1

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InChIKey

OGDKBMIXPVDZEL-CFSBILQPSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OGDKBMIXPVDZEL-CFSBILQPSA-N

1 reference

(Q105191552)

(1S,2R,4aR,4bS,8R,8aR)-2-ethenyl-8-(hydroxymethyl)-2,4b,8-trimethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthren-1-ol

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