(Q105128782)

English

(1R,4S,6R,9S,10R,12S,13S,14R)-5,5,9,13-tetramethylpentacyclo[11.2.1.01,10.04,9.012,14]hexadecan-6-ol

chemical compound

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instance of

type of chemical entity

0 references

subclass of

5,5,9,13-Tetramethylpentacyclo[11.2.1.01,10.04,9.012,14]hexadecan-6-ol

1 reference

based on heuristic

inferred from SMILES

ent-Trachyloban-3 beta-ol

1 reference

based on heuristic

inferred from SMILES

(1S,4S,6S,9S,10R,12S,13S)-5,5,9,13-tetramethylpentacyclo[11.2.1.01,10.04,9.012,14]hexadecan-6-ol

1 reference

based on heuristic

inferred from SMILES

mass

288.245315644 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Trachylobane-3alpha-ol

1 reference

based on heuristic

inferred from InChI

(1S,4R,6R,9S,10R,12R,13R,14S)-5,5,9,13-tetramethylpentacyclo[11.2.1.01,10.04,9.012,14]hexadecan-6-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₂O

0 references

canonical SMILES

OC1CCC2(C)C(CCC34CC5C(CC23)C5(C)C4)C1(C)C

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isomeric SMILES

CC1(C)[C@H]2CC[C@]34C[C@@H]5[C@H](C[C@H]3[C@]2(C)CC[C@H]1O)[C@]5(C)C4

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found in taxon

Jungermannia exsertifolia

1 reference

stated in

Structure and anti-TB activity of trachylobanes from the liverwort Jungermannia exsertifolia ssp. cordifolia

Identifiers

InChI

InChI=1S/C20H32O/c1-17(2)14-5-8-20-10-13-12(19(13,4)11-20)9-15(20)18(14,3)7-6-16(17)21/h12-16,21H,5-11H2,1-4H3/t12-,13+,14+,15-,16+,18+,19-,20+/m0/s1

0 references

InChIKey

JHYUVBXKRVZLON-JLMQNVNHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JHYUVBXKRVZLON-JLMQNVNHSA-N

(Q105128782)

(1R,4S,6R,9S,10R,12S,13S,14R)-5,5,9,13-tetramethylpentacyclo[11.2.1.01,10.04,9.012,14]hexadecan-6-ol

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Identifiers

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