(Q105255694)

English

(1R,2R,5S,8R,14R,15S,16R,18R)-15-formyl-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5-carboxylic acid

group of stereoisomers with the chemical formula C₃₀H₄₆O₄

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

470.339609952 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₆O₄

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canonical SMILES

O=CC1C(O)C(C)(C)C2CCC3(C)C(CCC4C5C(C(=C)C)CCC5(C(=O)O)CCC43C)C12C

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isomeric SMILES

C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(CCC4[C@@]5(C)[C@H](C=O)[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)C12

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found in taxon

Ziziphus cambodiana

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stated in

Ceanothane- and lupane-type triterpenes with antiplasmodial and antimycobacterial activities from Ziziphus cambodiana

Identifiers

InChI

InChI=1S/C30H46O4/c1-17(2)18-10-13-30(25(33)34)15-14-27(5)19(23(18)30)8-9-22-28(27,6)12-11-21-26(3,4)24(32)20(16-31)29(21,22)7/h16,18-24,32H,1,8-15H2,2-7H3,(H,33,34)/t18-,19?,20+,21-,22?,23?,24+,27+,28+,29-,30-/m0/s1

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InChIKey

SLWJVQQNDGLXTK-DDKVZRHZSA-N

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2 references

2 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

SLWJVQQNDGLXTK-DDKVZRHZSA-N

1 reference

(Q105255694)

(1R,2R,5S,8R,14R,15S,16R,18R)-15-formyl-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5-carboxylic acid

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Identifiers

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