(Q104947385)

English

(1R,3S,4S,6R,8R,9S,10S,13S,14R,16S)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,8]hexadecane-3,4,6,9,14,16-hexol

chemical compound

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instance of

type of chemical entity

0 references

subclass of

(1S,4R,8S,9R,10S,13S,14R,16R)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,8]hexadecane-3,4,6,9,14,16-hexol

1 reference

1 reference

370.235538808 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,3S,4S,6R,8S,9R,10S,13S,14S,16R)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,8]hexadecane-3,4,6,9,14,16-hexol

2 references

based on heuristic

inferred from InChIKey

1 reference

inferred from InChIKey

(1S,3R,4R,6S,8R,9R,10R,13R,14R,16S)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,8]hexadecane-3,4,6,9,14,16-hexol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,3R,4R,6R,8S,9R,10R,13R,14R,16S)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,8]hexadecane-3,4,6,9,14,16-hexol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₄O₆

0 references

canonical SMILES

OC1CC2C(O)(C)C3CCC4C(O)C3(CC(O)C2(O)C1(C)C)CC4(O)C

0 references

isomeric SMILES

CC1(C)[C@H](O)C[C@@H]2[C@@](C)(O)[C@H]3CC[C@H]4[C@H](O)[C@]3(C[C@H](O)[C@]21O)C[C@@]4(C)O

0 references

found in taxon

Rhododendron molle

3 references

stated in

Tandem solid-phase extraction followed by HPLC-ESI/QTOF/MS/MS for rapid screening and structural identification of trace diterpenoids in flowers of Rhododendron molle

stated in

Grayanane diterpenoids from the flowers of Rhododendron molle with cytotoxic activity against a Spodoptera frugiperda cell line

stated in

Grayanoid diterpene insect antifeedants and insecticides from Rhododendron molle

Kalmia latifolia

1 reference

stated in

Antifeedant Diterpenes For the Gypsy Moth Larvae From Kalmia latifolia: Isolation and Characterization of Ten Grayanoids

Leucothoe grayana

2 references

stated in

Isolation of iso-grayanotoxin II from leaves of Leucothoe grayana Max. Its X-ray crystallographic analysis and acute toxicity in mice

stated in

Quantitative structure-inotropy relationship applied to substituted grayanotoxins.

Identifiers

InChI

InChI=1S/C20H34O6/c1-16(2)13(21)7-12-18(4,25)11-6-5-10-15(23)19(11,9-17(10,3)24)8-14(22)20(12,16)26/h10-15,21-26H,5-9H2,1-4H3/t10-,11+,12+,13+,14-,15-,17+,18-,19+,20+/m0/s1

0 references

InChIKey

BWMFRQKICHXLSH-ROASOBKTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BWMFRQKICHXLSH-ROASOBKTSA-N

1 reference

(Q104947385)

(1R,3S,4S,6R,8R,9S,10S,13S,14R,16S)-5,5,9,14-tetramethyltetracyclo[11.2.1.01,10.04,8]hexadecane-3,4,6,9,14,16-hexol

Statements

Identifiers

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