(Q105135485)

English

15-(5-Hydroperoxy-6-methylhept-6-en-2-yl)-4-hydroxy-7,12,16-trimethyl-6-(3,4,5-trihydroxyoxan-2-yl)oxypentacyclo[9.7.0.01,3.03,8.012,16]octadecane-7-carboxylic acid

group of stereoisomers with the chemical formula C₃₅H₅₆O₁₀

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Statements

instance of

group of stereoisomers

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subclass of

cycloartane triterpenoid

1 reference

inferred from

cycloartane triterpenoid

mass

636.387347992 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₅H₅₆O₁₀

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canonical SMILES

O=C(O)C1(C)C(OC2OCC(O)C(O)C2O)CC(O)C34CC54CCC6(C)C(CCC6(C)C5CCC13)C(C)CCC(OO)C(=C)C

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Identifiers

InChI

InChI=1S/C35H56O10/c1-18(2)22(45-42)8-7-19(3)20-11-12-32(5)23-9-10-24-33(6,30(40)41)26(44-29-28(39)27(38)21(36)16-43-29)15-25(37)35(24)17-34(23,35)14-13-31(20,32)4/h19-29,36-39,42H,1,7-17H2,2-6H3,(H,40,41)

0 references

InChIKey

JUWZHLSWTBIIQV-UHFFFAOYSA-N

0 references

PubChem CID

163030557

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

JUWZHLSWTBIIQV-UHFFFAOYSA-N

(Q105135485)

15-(5-Hydroperoxy-6-methylhept-6-en-2-yl)-4-hydroxy-7,12,16-trimethyl-6-(3,4,5-trihydroxyoxan-2-yl)oxypentacyclo[9.7.0.01,3.03,8.012,16]octadecane-7-carboxylic acid

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