ID: 59683
SMILES:C(C)(C)CC(=O)c1c(C2C=C(C)CCC2C(C)=C)c(O)cc(CCCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -12.419
InChIKey:LJSQGDFEOMLNIP-UHFFFAOYSA-N
ID: 59684
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 59685
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 59686
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 59687
SMILES:Oc1c(C2C=C(CO)CCC2C(C)=CCC=C(C)C)cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.762
InChIKey:LIZKOLQSRXTADH-UHFFFAOYSA-N
ID: 59688
SMILES:C(C1=CC2C(C(C)(C)Oc3c2c(OC)cc(CCC)c3)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -13.139
InChIKey:KPBWXMFTMRKIDV-UHFFFAOYSA-N
ID: 59689
SMILES:C1C(C)(CCC(=O)C(C)=C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.239
InChIKey:XTNUJMAPGKQNOB-UHFFFAOYSA-N
ID: 59690
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 59691
SMILES:OC1(CSC)CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.578
CB1 binding score: -16.478
InChIKey:WGVQMWXECQROED-UHFFFAOYSA-N
ID: 59692
SMILES:C12=CC(c3c(O)cc(CCCCC)c(C(=O)OC(C)CCC)c3O)OC1(C)CCCC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -13.842
InChIKey:HURMASUMQPPOMQ-UHFFFAOYSA-N
ID: 59693
SMILES:C1(C)(C)Oc2ccc(CCCCC)cc2C=C1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.619
InChIKey:AZGOOCZNLHAPQD-UHFFFAOYSA-N
ID: 59694
SMILES:CC1(C(=O)O)CCC2(C)C(C1)C1(C(C)CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.181
InChIKey:AGASNYQSDBHZGL-UHFFFAOYSA-N
ID: 59695
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -16.383
InChIKey:ZXKSYMYVWVYZNK-UHFFFAOYSA-N
ID: 59696
SMILES:C12(CO)C(CC(C)(C)CC1)c1c(O)c(O)c(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.379
InChIKey:HSTCVHDXOOWVJS-UHFFFAOYSA-N
ID: 59697
SMILES:C(C(C)C)C1c2c(C)c3c(cc2CCC1(C)C)OC(C)(C)C1CC=C(C)CC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.616
CB1 binding score: -17.982
InChIKey:HYQUCTXWJSXPSY-UHFFFAOYSA-N
ID: 59698
SMILES:c1c(C)c(O)cc2c1-c1c(cc(CCCCC)cc1O)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -13.363
InChIKey:QDPXVRLBCOQCEA-UHFFFAOYSA-N
ID: 59699
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(CCC=C(C)C)C(C1)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.226
InChIKey:WXXQCIBQUUNMGD-UHFFFAOYSA-N
ID: 59700
SMILES:C(C)(=CCC1(CC=C(C)C)c2c3c(cc(O)cc3O1)occc2OC)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -13.765
InChIKey:MRCVXCXODVUGKE-UHFFFAOYSA-N
ID: 59701
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(OC)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 59702
SMILES:Oc1c(CC=C(C)C)c(O)c(C=O)c(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.049
InChIKey:UTQODHOHWHAWHC-UHFFFAOYSA-N
ID: 59703
SMILES:c1(CCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N