(Q105232376)

English

(3S,7S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

chemical compound

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instance of

type of chemical entity

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subclass of

17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

1 reference

based on heuristic

inferred from SMILES

mass

416.365430776 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

7α-hydroxycampesterol

1 reference

based on heuristic

inferred from InChI

7beta-Hydroxycampesterol

1 reference

based on heuristic

inferred from InChI

Ergosta-5-ene-3beta,7beta-diol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₄₈O₂

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canonical SMILES

OC1C=C2CC(O)CCC2(C)C3CCC4(C)C(CCC4C13)C(C)CCC(C)C(C)C

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isomeric SMILES

CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C

0 references

found in taxon

Euphorbia fischeriana

1 reference

stated in

7-Oxo-, 7α-hydroxy- and 7β-hydroxysterols from Euphorbia fischeriana

Euphorbia fischeri

1 reference

stated in

7-Oxo-, 7α-hydroxy- and 7β-hydroxysterols from Euphorbia fischeriana

Lobophytum laevigatum

1 reference

stated in

Cytotoxic and PPARs transcriptional activities of sterols from the Vietnamese soft coral Lobophytum laevigatum.

Identifiers

InChI

InChI=1S/C28H48O2/c1-17(2)18(3)7-8-19(4)22-9-10-23-26-24(12-14-28(22,23)6)27(5)13-11-21(29)15-20(27)16-25(26)30/h16-19,21-26,29-30H,7-15H2,1-6H3/t18-,19+,21-,22+,23-,24-,25+,26-,27-,28+/m0/s1

0 references

InChIKey

QZTNWQQTEVRSMC-JECVZSANSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QZTNWQQTEVRSMC-JECVZSANSA-N

1 reference

(Q105232376)

(3S,7S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

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Identifiers

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