(Q104971918)

English

[21,22-Dihydroxy-1,6,6,15,17,20,20-heptamethyl-7-(3,4,5-trihydroxyoxan-2-yl)oxy-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-14-yl] acetate

group of stereoisomers with the chemical formula C₃₇H₅₈O₁₁

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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

678.397912676 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₇H₅₈O₁₁

0 references

canonical SMILES

O=C(OC1CC23CC43CCC(OC5OCC(O)C(O)C5O)C(C)(C)C4CCC2C6(C)CC7OC8(O)C(O)C(OC8C(C)C7C16C)(C)C)C

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Identifiers

InChI

InChI=1S/C37H58O11/c1-17-25-20(47-37(43)28(17)48-32(5,6)30(37)42)13-33(7)22-10-9-21-31(3,4)23(46-29-27(41)26(40)19(39)15-44-29)11-12-35(21)16-36(22,35)14-24(34(25,33)8)45-18(2)38/h17,19-30,39-43H,9-16H2,1-8H3

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InChIKey

CXMFZKKIWJFZLS-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CXMFZKKIWJFZLS-UHFFFAOYSA-N

(Q104971918)

[21,22-Dihydroxy-1,6,6,15,17,20,20-heptamethyl-7-(3,4,5-trihydroxyoxan-2-yl)oxy-19,23-dioxaheptacyclo[13.10.0.02,12.05,10.010,12.016,24.018,22]pentacosan-14-yl] acetate

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Identifiers

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