Summary

IMPPAT Phytochemical identifier: IMPHY002804

Phytochemical name: Corchioside A

Synonymous chemical names:
corchioside a, corchioside a (orcinol-3β-d-xylopyranosyl (1→6)-β-d-glucopyranoside), phenolic glycoside-corchiolside a

External chemical identifiers:
CID:14309741, ZINC:ZINC000238770893

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Chemical structure information

SMILES:
Cc1cc(cc(c1)O)O[C@@H]1O[C@H](CO[C@@H]2OC[C@H]([C@@H]([C@H]2O)O)O)[C@H]([C@@H]([C@H]1O)O)O

InChI:
InChI=1S/C18H26O11/c1-7-2-8(19)4-9(3-7)28-18-16(25)14(23)13(22)11(29-18)6-27-17-15(24)12(21)10(20)5-26-17/h2-4,10-25H,5-6H2,1H3/t10-,11-,12+,13-,14+,15-,16-,17+,18-/m1/s1

InChIKey:
UOVCYPNTMQKFJE-NWQIESHVSA-N

DeepSMILES:
Ccccccc6)O)))O[C@@H]O[C@H]CO[C@@H]OC[C@H][C@@H][C@H]6O))O))O)))))))[C@H][C@@H][C@H]6O))O))O

Functional groups:
CO, CO[C@@H](C)OC, cO, cO[C@@H](C)OC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc(OC2CCCC(COC3CCCCO3)O2)cc1

Scaffold Graph/Node level:
C1CCC(OC2CCCC(COC3CCCCO3)O2)CC1

Scaffold Graph level:
C1CCC(CCC2CCCC(CC3CCCCC3)C2)CC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Carbohydrates and carbohydrate conjugates

NP Classifier Biosynthetic pathway: Polyketides

NP-Likeness score: 1.991

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Chemical structure download