(Q104375091)

English

(1S,3R,8R,11R,12S,16R)-7,7,12,16-tetramethyl-15-(6-methyl-5-methylideneheptan-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one

group of stereoisomers with the chemical formula C₃₁H₅₀O

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Statements

instance of

group of stereoisomers

0 references

subclass of

24-methylcycloartane steroid

1 reference

inferred from

24-methylcycloartane steroid

mass

438.38616622 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₅₀O

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canonical SMILES

O=C1CCC23CC43CCC5(C)C(CCC5(C)C4CCC2C1(C)C)C(C)CCC(=C)C(C)C

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isomeric SMILES

C=C(CCC(C)C1CC[C@@]2(C)[C@H]3CC[C@H]4C(C)(C)C(=O)CC[C@@]45C[C@@]35CC[C@]12C)C(C)C

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found in taxon

Costus tonkinensis

1 reference

stated in

24-Methylpollinastanone, related triterpenoids and sterols from Costus tonkinensis

Acanthosicyos horridus

1 reference

stated in

Cucurbitacins from Acanthosicyos horridus

Artocarpus integer

1 reference

stated in

A New Prenylated Flavone fromArtocarpus champeden

Euphorbia piscatoria

1 reference

stated in

Tetra- and Pentacyclic Triterpenes from the Aerial Parts of Euphorbia piscatoria

Euphorbia retusa

1 reference

stated in

Diterpenoids and triterpenoids from Euphorbia guyoniana

Heritiera ornithocephala

1 reference

stated in

Sesquiterpenes from Heritiera ornithocephala

Tillandsia recurvata

1 reference

stated in

Hydroperoxycycloartanes from Tillandsia recurvata

Tillandsia usneoides

1 reference

stated in

Cycloartane Derivatives fromTillandsia usneoides

Lepisorus fortunei

1 reference

stated in

Chemical and Chemotaxonomical Studies on Filices. LVII. Chemical Studies on the Constituents of Colysis hemionitidea (WALL) PRESL. and Microsorium fortunei (MOORE) CHING

Euphorbia sulcata

1 reference

stated in

Diterpenoids and triterpenoids from Euphorbia guyoniana

Identifiers

InChI

InChI=1S/C31H50O/c1-20(2)21(3)9-10-22(4)23-13-15-29(8)25-12-11-24-27(5,6)26(32)14-16-30(24)19-31(25,30)18-17-28(23,29)7/h20,22-25H,3,9-19H2,1-2,4-8H3/t22?,23?,24-,25+,28+,29-,30+,31-/m0/s1

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InChIKey

AEAWOMODYBIREN-SXWLXBIUSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AEAWOMODYBIREN-SXWLXBIUSA-N

(Q104375091)

(1S,3R,8R,11R,12S,16R)-7,7,12,16-tetramethyl-15-(6-methyl-5-methylideneheptan-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one

Statements

Identifiers

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