(Q105164061)

English

(3S,11S)-3,7,14-trihydroxy-18,18-dimethyl-11-(3-methylbut-2-enyl)-2,10,17-trioxapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(13),4(9),5,7,14,16(21),19-heptaen-12-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3,7,14-Trihydroxy-18,18-dimethyl-11-(3-methylbut-2-enyl)-2,10,17-trioxapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(13),4(9),5,7,14,16(21),19-heptaen-12-one

1 reference

based on heuristic

inferred from SMILES

mass

436.152203108 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₂₄O₇

0 references

canonical SMILES

O=C1C2=C(O)C=C3OC(C=CC3=C2OC4(O)C5=CC=C(O)C=C5OC14CC=C(C)C)(C)C

0 references

isomeric SMILES

CC(C)=CC[C@@]12Oc3cc(O)ccc3[C@]1(O)Oc1c3c(cc(O)c1C2=O)OC(C)(C)C=C3

0 references

found in taxon

Morus cathayana

2 references

stated in

Isoprenylated flavanones from Morus cathayana

stated in

Components of the Root Bark of Morus cathayana. 1. Structures of Five New Isoprenylated Flavonoids, Sanggenols A - E and a Diprenyl-2-arylbenzofuran, Mulberrofuran V

Identifiers

InChI

InChI=1S/C25H24O7/c1-13(2)7-10-24-22(28)20-17(27)12-18-15(8-9-23(3,4)30-18)21(20)32-25(24,29)16-6-5-14(26)11-19(16)31-24/h5-9,11-12,26-27,29H,10H2,1-4H3/t24-,25-/m0/s1

0 references

InChIKey

MHRZMNXTSUHNDN-DQEYMECFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MHRZMNXTSUHNDN-DQEYMECFSA-N

(Q105164061)

(3S,11S)-3,7,14-trihydroxy-18,18-dimethyl-11-(3-methylbut-2-enyl)-2,10,17-trioxapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(13),4(9),5,7,14,16(21),19-heptaen-12-one

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