(Q105212650)

English

(Z)-4-[(1R,2R,7R,16S,18S)-11-hydroxy-16-methoxy-6,6,7,20,20-pentamethyl-10-(3-methylbut-2-enyl)-13,17-dioxo-3,8,19-trioxahexacyclo[14.4.1.02,14.02,18.04,12.05,9]henicosa-4(12),5(9),10,14-tetraen-18-yl]-2-methylbut-2-enoic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

4-[11-Hydroxy-16-methoxy-6,6,7,20,20-pentamethyl-10-(3-methylbut-2-enyl)-13,17-dioxo-3,8,19-trioxahexacyclo[14.4.1.02,14.02,18.04,12.05,9]henicosa-4(12),5(9),10,14-tetraen-18-yl]-2-methylbut-2-enoic acid

1 reference

based on heuristic

inferred from SMILES

mass

592.26723286 dalton

1 reference

1 reference

(2E)-4-[(1S,3aR,5S,12aR,14S)-9-(3-Methyl-2-butenyl)-3,3,13,13,14-pentamethyl-5-methoxy-8-hydroxy-3,3a,4,5-tetrahydro-1,5-methano-10,11-(epoxyethano)-7,16-dioxo-7H-furo[3,4-d]xanthene-1-yl]-2-methyl-2-butenoic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₄H₄₀O₉

0 references

canonical SMILES

O=C(O)C(=CCC12OC(C)(C)C3CC(OC)(C=C4C(=O)C=5C(O)=C(C=6OC(C)C(C6C5OC431)(C)C)CC=C(C)C)C2=O)C

0 references

isomeric SMILES

CO[C@]12C=C3C(=O)c4c(O)c(CC=C(C)C)c5c(c4O[C@]34[C@H](C1)C(C)(C)O[C@]4(C/C=C(/C)C(=O)O)C2=O)C(C)(C)[C@@H](C)O5

0 references

found in taxon

Garcinia scortechinii

3 references

stated in

Xanthone and sesquiterpene derivatives from the fruits of Garcinia scortechinii

stated in

Caged-Tetraprenylated Xanthones from Garcinia scortechinii

stated in

Caged-triprenylated and -tetraprenylated xanthones from the latex of Garcinia scortechinii

Garcinia acuminata

3 references

stated in

Xanthone and sesquiterpene derivatives from the fruits of Garcinia scortechinii

stated in

Caged-triprenylated and -tetraprenylated xanthones from the latex of Garcinia scortechinii

stated in

Caged-Tetraprenylated Xanthones from Garcinia scortechinii

Garcinia dulcis

3 references

stated in

Xanthone and sesquiterpene derivatives from the fruits of Garcinia scortechinii

stated in

Caged-triprenylated and -tetraprenylated xanthones from the latex of Garcinia scortechinii

stated in

Caged-Tetraprenylated Xanthones from Garcinia scortechinii

Garcinia ovalifolia

3 references

stated in

Xanthone and sesquiterpene derivatives from the fruits of Garcinia scortechinii

stated in

Caged-triprenylated and -tetraprenylated xanthones from the latex of Garcinia scortechinii

stated in

Caged-Tetraprenylated Xanthones from Garcinia scortechinii

Garcinia elliptica

3 references

stated in

Xanthone and sesquiterpene derivatives from the fruits of Garcinia scortechinii

stated in

Caged-triprenylated and -tetraprenylated xanthones from the latex of Garcinia scortechinii

stated in

Caged-Tetraprenylated Xanthones from Garcinia scortechinii

Identifiers

InChI

InChI=1S/C34H40O9/c1-16(2)10-11-19-24(35)22-25(36)20-14-32(40-9)15-21-31(7,8)43-33(29(32)39,13-12-17(3)28(37)38)34(20,21)42-27(22)23-26(19)41-18(4)30(23,5)6/h10,12,14,18,21,35H,11,13,15H2,1-9H3,(H,37,38)/b17-12-/t18-,21-,32-,33-,34+/m1/s1

0 references

InChIKey

POTOKMBTWJNFNG-RMQYARJRSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

POTOKMBTWJNFNG-RMQYARJRSA-N

(Q105212650)

(Z)-4-[(1R,2R,7R,16S,18S)-11-hydroxy-16-methoxy-6,6,7,20,20-pentamethyl-10-(3-methylbut-2-enyl)-13,17-dioxo-3,8,19-trioxahexacyclo[14.4.1.02,14.02,18.04,12.05,9]henicosa-4(12),5(9),10,14-tetraen-18-yl]-2-methylbut-2-enoic acid

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Identifiers

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