(Q105020357)

English

[(1R,2R,4R,6S,9R,10R,13S,16R)-2,10,16-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

chemical compound

In more languages

default values for all languages

No label defined

No description defined

edit

Statements

instance of

type of chemical entity

0 references

subclass of

[(6S,10R,16S)-2,10,16-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

1 reference

based on heuristic

inferred from SMILES

(2,10,16-Trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate

1 reference

based on heuristic

inferred from SMILES

(6S,10R)-2,10,16-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-6-yl acetate

1 reference

based on heuristic

inferred from SMILES

mass

392.219888744 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₃₂O₆

0 references

canonical SMILES

O=C(OC1CCC2(C)C(CC(O)C34C(=O)C(=C)C(CCC32O)C4O)C1(C)C)C

0 references

isomeric SMILES

C=C1C(=O)[C@@]23[C@H](O)C[C@@H]4C(C)(C)[C@@H](OC(C)=O)CC[C@@]4(C)[C@]2(O)CC[C@@H]1[C@H]3O

0 references

found in taxon

Isodon shikokianus

2 references

stated in

Terpenoids. XLVIII. New diterpenoids from Rabdosia shikokiana var. occidentalis.

stated in

Rabdoshikoccins a and B, 8,9-seco-ent-kaurenoids from Rabdosia shikokiana var. occidentalis

Isodon umbrosus

3 references

stated in

Structure of rabdolatifolin, a diterpenoid from Rabdosia umbrosa var. Latifolia

stated in

Bitter diterpenoids from Isodon shikokianus var. Intermedius

stated in

Diterpenoid constituents of Rabdosia umbrosa (MAXIM.) HARA: Isolation and structure elucidation of two new diterpenoids, umbrosianin and rabdoumbrosanin.

Identifiers

InChI

InChI=1S/C22H32O6/c1-11-13-6-9-21(27)20(5)8-7-16(28-12(2)23)19(3,4)14(20)10-15(24)22(21,17(11)25)18(13)26/h13-16,18,24,26-27H,1,6-10H2,2-5H3/t13-,14+,15+,16-,18+,20+,21+,22+/m0/s1

0 references

InChIKey

GUPYZKQZOPXFIL-CBSXARQDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GUPYZKQZOPXFIL-CBSXARQDSA-N

1 reference

(Q105020357)

[(1R,2R,4R,6S,9R,10R,13S,16R)-2,10,16-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-6-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)