(Q105270210)

English

(1S,2S,5S,8R,11R,12R)-5-methoxy-2,12-dimethyl-6-methylidene-16-oxapentacyclo[10.3.2.15,8.01,11.02,8]octadecane-7,17-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

5-methoxy-2,12-dimethyl-6-methylidene-16-oxapentacyclo[10.3.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecane-7,17-dione

1 reference

based on heuristic

inferred from SMILES

mass

344.198759376 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,2S,5S,8R,11S,12R)-5-methoxy-2,12-dimethyl-6-methylidene-16-oxapentacyclo[10.3.2.15,8.01,11.02,8]octadecane-7,17-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₈O₄

0 references

canonical SMILES

O=C1OC23CCCC1(C)C3CCC45C(=O)C(=C)C(OC)(CCC24C)C5

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isomeric SMILES

C=C1C(=O)[C@@]23CC[C@H]4[C@@]5(CCC[C@@]4(C)C(=O)O5)[C@@]2(C)CC[C@]1(OC)C3

0 references

found in taxon

Parinari capensis

3 references

stated in

Antimalarial compounds from Parinari capensis

stated in

Absolute Configuration of a Diterpene Lactone fromParinari capensis

stated in

In vitro anticancer screening of South African plants

Parinari curatellifolia

1 reference

stated in

In vitro anticancer screening of South African plants

Identifiers

InChI

InChI=1S/C21H28O4/c1-13-15(22)19-9-6-14-17(2)7-5-8-21(14,25-16(17)23)18(19,3)10-11-20(13,12-19)24-4/h14H,1,5-12H2,2-4H3/t14-,17-,18+,19+,20+,21+/m1/s1

0 references

InChIKey

UCXBBKCPRLOQQA-HQHFYQKISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UCXBBKCPRLOQQA-HQHFYQKISA-N

1 reference

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