(Q105161499)

English

(3S,5R,9S,10S,13R,14S,17S)-10,13-dimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

412.370516156 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,5S,9R,10S,13R,14R,17R)-17-((R,E)-5-Isopropylhept-5-en-2-yl)-10,13-dimethyl-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,5R,9R,10S,13R,14R,17R)-10,13-dimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

1 reference

C₂₉H₄₈O

0 references

canonical SMILES

OC1CCC2(C)C3C(=CCC2C1)C4CCC(C(C)CCC(=CC)C(C)C)C4(C)CC3

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isomeric SMILES

C/C=C(/CC[C@@H](C)[C@@H]1CC[C@@H]2C3=CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@@]21C)C(C)C

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found in taxon

Coffea canephora

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea charrieriana

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea congensis

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea eugenioides

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea heterocalyx

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea humblotiana

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea humilis

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea kapakata

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea pseudozanguebariae

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea racemosa

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea salvatrix

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea sessiliflora

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea stenophylla

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Nicotiana benthamiana

1 reference

stated in

Virus-induced silencing of sterol biosynthetic genes: identification of a Nicotiana tabacum L. obtusifoliol-14alpha-demethylase (CYP51) by genetic manipulation of the sterol biosynthetic pathway in Nicotiana benthamiana L.

Coffea liberica var. dewevrei

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Coffea liberica var. liberica

1 reference

stated in

Effectiveness of the fatty acid and sterol composition of seeds for the chemotaxonomy of Coffea subgenus Coffea

Spinacia oleracea

1 reference

stated in

Ecdysteroid biosynthesis during the ontogeny of spinach leaves

common sunflower

1 reference

stated in

24α-Methyl-5α-cholest-7-en-3β-ol from seed oil of Helianthus annuus

Oryza sativa

2 references

stated in

Assessment of nutritional value and quantitative analysis of bioactive phytochemicals through targeted LC-MS/MS method in selected scented and pigmented rice varietals

1 reference

Plant cholesterol biosynthetic pathway overlaps with phytosterol metabolism.

Identifiers

InChI

InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,11,19-20,22-23,25-27,30H,8-10,12-18H2,1-6H3/b21-7-/t20-,22-,23+,25+,26-,27-,28+,29-/m1/s1

0 references

InChIKey

MCWVPSBQQXUCTB-NFWLSWQQSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105161499)

(3S,5R,9S,10S,13R,14S,17S)-10,13-dimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

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Identifiers

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