ID: 87004
SMILES:C(C)(CCC1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -5.323
InChIKey:GIRSLXNAUWJDSD-UHFFFAOYSA-N
ID: 87005
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CCCC(C)CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 386.62
CB1 binding score: -17.716
InChIKey:BZTBKODETSOKKB-UHFFFAOYSA-N
ID: 87006
SMILES:O1c2c(cc(CCCCC)cc2O)C2C1(C)C(C)CCC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.294
InChIKey:NSLRYRIZDXBDRJ-UHFFFAOYSA-N
ID: 87007
SMILES:O(C(C=C(C)C)=O)c1c(OC(=O)C)c2c(c(C=O)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.481
CB1 binding score: -15.29
InChIKey:GREOWXFJDVXGQL-UHFFFAOYSA-N
ID: 87008
SMILES:c1(C(C)(CCCC(C)C)O)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.998
InChIKey:RYVISNKWDRRLSZ-UHFFFAOYSA-N
ID: 87009
SMILES:C12C(C(C)(C)Oc3cc(CCCCCN=C[N+](=O)O)c(O)c(O)c31)CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 403.499
CB1 binding score: -14.605
InChIKey:LDNDCBAWTCFEOE-UHFFFAOYSA-O
ID: 87010
SMILES:C1=C(C)C(O)CC2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.238
InChIKey:QNATXLRIBKPNMJ-UHFFFAOYSA-N
ID: 87011
SMILES:Oc1c(C(C(C)CC)=O)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.563
InChIKey:KFHWFLUEGBMEIL-UHFFFAOYSA-N
ID: 87012
SMILES:CC(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 87013
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC3C(C)(O3)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.601
InChIKey:DNJIZVHKLOZUAL-UHFFFAOYSA-N
ID: 87014
SMILES:C(C)(C1=CCC2(C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C2)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -12.999
InChIKey:MSQDJJZEXNOSFY-UHFFFAOYSA-N
ID: 87015
SMILES:C(C1C(C)(C)Oc2c1c(O)cc(CCCCC)c2O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.592
InChIKey:MOTRJRBUOOVQPZ-UHFFFAOYSA-N
ID: 87016
SMILES:c1(O)cc(C)c(OC(C)=O)c(CC=C(CCC=C(C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.936
InChIKey:HBMZKHKKECAQEH-UHFFFAOYSA-N
ID: 87017
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CC=C(C)C1)C(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.559
InChIKey:NEOMHYIKJUAVNS-UHFFFAOYSA-N
ID: 87018
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 87019
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c(C(=O)CC(C)C)c(O)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.831
InChIKey:YHIVFUIEZCDTGJ-UHFFFAOYSA-N
ID: 87020
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 87021
SMILES:C(Cc1cc(O)cc(CC=C(C)CCC=C(C)C)c1O)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 87022
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 87023
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(C)ccc23)CC1)CC(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -12.141
InChIKey:UHCAUNFQFJOUKY-UHFFFAOYSA-N
ID: 87024
SMILES:C(CCc1cc2c(c(O)c1)C1C(=C(C)C2)CCC1C(=C)C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -16.304
InChIKey:MRBLKGMXSSYOMP-UHFFFAOYSA-N