(Q76294340)

English

Chondrillast-7-enol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

22-Dihydrochondrillasterol

1 reference

based on heuristic

inferred from SMILES

24-Ethyl-5alpha-cholest-7-en-3beta-ol

1 reference

1 reference

delta(7)-Stigmastenol

1 reference

based on heuristic

inferred from SMILES

17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

based on heuristic

inferred from SMILES

mass

414.38616622 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3β,5α)-stigmast-7-en-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

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

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₉H₅₀O

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canonical SMILES

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

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isomeric SMILES

CC[C@@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C

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found in taxon

Agelas oroides

1 reference

stated in

Marine natural products from the Turkish sponge Agelas oroides that inhibit the enoyl reductases from Plasmodium falciparum, Mycobacterium tuberculosis and Escherichia coli.

Axinella cannabina

1 reference

stated in

Minor and trace sterols in marine invertebrates. Part 35. Isolation and structure elucidation of seventy-four sterols from the sponge Axinella cannabina

Dunaliella tertiolecta

1 reference

stated in

Minor and trace sterols of Dunaliella tertiolecta

Identifiers

InChI

InChI=1S/C29H50O/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/h11,19-23,25-27,30H,7-10,12-18H2,1-6H3/t20-,21+,22+,23+,25-,26+,27+,28+,29-/m1/s1

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InChIKey

YSKVBPGQYRAUQO-XCFYOIDPSA-N

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mapping relation type

exact match

1 reference

stated in

ChEBI release 2022-06-13

1 reference

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

1 reference

inferred from InChIKey

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

retrieved

30 June 2018

(Q76294340)

Chondrillast-7-enol

Statements

Identifiers

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