(Q105196228)

English

(3S,8S,9S,10R,13R,14S,17R)-17-[(1R,4R)-4-hydroxy-4-isopropyl-1-methyl-hex-5-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

chemical compound

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instance of

type of chemical entity

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subclass of

17-(5-hydroxy-5-propan-2-ylhept-6-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

1 reference

428.365430776 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,8R,9R,10R,13R,14R,17R)-17-[(2R,5R)-5-hydroxy-5-propan-2-ylhept-6-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,8S,9R,10R,13S,14S,17S)-17-[(2R,5R)-5-hydroxy-5-propan-2-ylhept-6-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

based on heuristic

inferred from InChI

(3S,8S,9S,10R,13R,14S,17R)-17-[(1R,4S)-4-hydroxy-4-isopropyl-1-methyl-hex-5-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₉H₄₈O₂

0 references

canonical SMILES

OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCC(O)(C=C)C(C)C)C2(C)CC1

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isomeric SMILES

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

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found in taxon

Caulerpa racemosa

1 reference

stated in

Bioactive constituents from the green alga Caulerpa racemosa

Cremanthodium discoideum

1 reference

stated in

Epoxide Sesquiterpenes and Steroids from Cremanthodium discoideum

Dictyota dichotoma

1 reference

stated in

Diterpenoid Hydroperoxides from the Far-Eastern Brown Alga Dictyota dichotoma

Eisenia bicyclis

1 reference

stated in

A C26 sterol from the brown alga Eisenia bicyclis

Enteromorpha linza

1 reference

stated in

Sterols from some black sea ulvaceae

Ulva linza

1 reference

stated in

Sterols from some black sea ulvaceae

Lessonia nigrescens

1 reference

stated in

Inhibition of Mycobacterium tuberculosis growth by saringosterol from Lessonia nigrescens.

Strychnos spinosa

1 reference

stated in

Antitrypanosomal activity of triterpenoids and sterols from the leaves of Strychnos spinosa and related compounds

Tridax procumbens

1 reference

stated in

Chemical-constituent diversity of Tridax procumbens

Identifiers

InChI

InChI=1S/C29H48O2/c1-7-29(31,19(2)3)17-12-20(4)24-10-11-25-23-9-8-21-18-22(30)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,19-20,22-26,30-31H,1,9-18H2,2-6H3/t20-,22+,23+,24-,25+,26+,27+,28-,29-/m1/s1

0 references

InChIKey

OPGVEUGCNGNPSX-MEBFPAKGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OPGVEUGCNGNPSX-MEBFPAKGSA-N

1 reference

(Q105196228)

(3S,8S,9S,10R,13R,14S,17R)-17-[(1R,4R)-4-hydroxy-4-isopropyl-1-methyl-hex-5-enyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Statements

Identifiers

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