(Q110194585)

English

2,7,11,24-Tetrahydroxy-10-(3-hydroxy-3-methylbut-1-enyl)-13-methyl-17-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexacyclo[14.8.0.02,11.03,8.010,15.018,23]tetracosa-1(24),3(8),4,6,13,16,18,20,22-nonaen-9-one

group of stereoisomers with the chemical formula C₃₆H₃₈O₁₂

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

662.236326656 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₃₈O₁₂

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canonical SMILES

O=C1C=2C(O)=CC=CC2C3(O)C4=C(O)C=5C=CC=CC5C(OC6OC(CO)C(O)C(O)C6O)=C4C7C=C(C)CC3(O)C17C=CC(O)(C)C

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found in taxon

Firmiana simplex

1 reference

stated in

Isoprenylated naphthoquinone dimers firmianones A, B, and C from Firmiana platanifolia

Identifiers

InChI

InChI=1S/C36H38O12/c1-16-13-20-24-25(26(39)17-7-4-5-8-18(17)30(24)48-32-29(42)28(41)27(40)22(15-37)47-32)36(46)19-9-6-10-21(38)23(19)31(43)34(20,35(36,45)14-16)12-11-33(2,3)44/h4-13,20,22,27-29,32,37-42,44-46H,14-15H2,1-3H3

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InChIKey

GKPCKVUULUVUKJ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GKPCKVUULUVUKJ-UHFFFAOYSA-N

(Q110194585)

2,7,11,24-Tetrahydroxy-10-(3-hydroxy-3-methylbut-1-enyl)-13-methyl-17-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexacyclo[14.8.0.02,11.03,8.010,15.018,23]tetracosa-1(24),3(8),4,6,13,16,18,20,22-nonaen-9-one

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