(Q104399395)

English

Ent-trachyloban-19-oic acid

group of stereoisomers with the chemical formula C₂₀H₃₀O₂

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

302.2245802 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₂

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canonical SMILES

O=C(O)C1(C)CCCC2(C)C1CCC34CC5C(CC32)C5(C)C4

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isomeric SMILES

C[C@@]12CCC[C@@](C)(C(=O)O)C1CC[C@@]13CC4[C@@H](CC12)[C@]4(C)C3

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found in taxon

Iostephane madrensis

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stated in

Polycyclic Diterpenes from the Roots of Iostephane madrensis

Croton insularis

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stated in

Diterpenes from Croton salutaris

Identifiers

InChI

InChI=1S/C20H30O2/c1-17-6-4-7-18(2,16(21)22)14(17)5-8-20-10-13-12(9-15(17)20)19(13,3)11-20/h12-15H,4-11H2,1-3H3,(H,21,22)/t12-,13?,14?,15?,17-,18-,19+,20+/m1/s1

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InChIKey

FLGAFUAMEXILLB-ZIJBZMAHSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

FLGAFUAMEXILLB-ZIJBZMAHSA-N

1 reference

(Q104399395)

Ent-trachyloban-19-oic acid

Statements

Identifiers

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