(Q105122772)

English

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

group of stereoisomers with the chemical formula C₃₂H₅₆O

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

456.433116412 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₂H₅₆O

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canonical SMILES

OC1CCC2C(CCC3C4(C)CCC(C(C)CCC(C(=C)C)C)C4(C)CCC23CC)C1(C)C

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isomeric SMILES

C=C(C)C(C)CCC(C)[C@H]1CCC2(C)[C@@H]3CCC4C(CC[C@H](O)C4(C)C)[C@]3(CC)CC[C@]12C

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found in taxon

Tillandsia fasciculata

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stated in

Triterpenoids from Tillandsia fasciculata

stated in

Triterpenoids from Tillandsia fasciculata

stated in

Triterpenoids from Tillandsia fasciculata

stated in

Triterpenoids from Tillandsia fasciculata

Coniogramme japonica

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stated in

The Chemical Constitutents ofConiogramme Japonica(Thunb.) Diels

Davallia mariesii

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stated in

Fern constituents: Two new triterpenoid hydrocarbons, hop-16-ene and isohop-22(29)-ene, isolated from Davallia mariesii.

Euphorbia aleppica

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stated in

Aleppicatines A and B from Euphorbia aleppica

Euphorbia nivulia

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stated in

Cycloart-25-en-2β-ol from Euphorbia nivulia

Oleandra wallichii

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stated in

Fern Constituents : Triterpenoids from Oleandra wallichii

Psilotum nudum

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stated in

Sterols and fatty acids of a whisk fernPsilotum nudum

Goniophlebium formosanum

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stated in

24S-Chirality of 24-alkylsterols possessing a Δ25-double bond from Polypodium formosanum

Davallia bullata

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stated in

Fern constituents: Two new triterpenoid hydrocarbons, hop-16-ene and isohop-22(29)-ene, isolated from Davallia mariesii.

Davallia trichomanoides

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stated in

Fern constituents: Two new triterpenoid hydrocarbons, hop-16-ene and isohop-22(29)-ene, isolated from Davallia mariesii.

Identifiers

InChI

InChI=1S/C32H56O/c1-10-32-20-19-30(8)24(23(5)12-11-22(4)21(2)3)17-18-31(30,9)27(32)15-13-25-26(32)14-16-28(33)29(25,6)7/h22-28,33H,2,10-20H2,1,3-9H3/t22?,23?,24-,25?,26?,27+,28+,30-,31?,32+/m1/s1

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InChIKey

IYJBFHKQCNLKBY-UQHHJGHBSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

IYJBFHKQCNLKBY-UQHHJGHBSA-N

1 reference

(Q105122772)

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

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Identifiers

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