Summary

IMPPAT Phytochemical identifier: IMPHY008979

Phytochemical name: Cannabiglendol

Synonymous chemical names:
cannabiglendol

Chemical structure information

SMILES:
CCCc1cc(O)c2c(c1)OC1(CC2C(CC1)C(O)(C)C)C

InChI:
InChI=1S/C19H28O3/c1-5-6-12-9-15(20)17-13-11-19(4,22-16(17)10-12)8-7-14(13)18(2,3)21/h9-10,13-14,20-21H,5-8,11H2,1-4H3

InChIKey:
RRQVSLLVCGRJNI-UHFFFAOYSA-N

DeepSMILES:
CCCcccO)ccc6)OCCC6CCC6))CO)C)C)))))C

Functional groups:
CO, cO, cOC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2c(c1)OC1CCCC2C1

Scaffold Graph/Node level:
C1CC2CC(C1)C1CCCCC1O2

Scaffold Graph level:
C1CCC2C(C1)CC1CCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Benzopyrans

ClassyFire Subclass: 1-benzopyrans

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Meroterpenoids

NP Classifier Class: Cannabinoids

NP-Likeness score: 2.28

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Chemical structure download