ID: 90049
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 90050
SMILES:Oc1c(C)c2c(c(C=O)c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.172
InChIKey:QJFXQKXGRGRKLJ-UHFFFAOYSA-N
ID: 90051
SMILES:C(=O)(C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 90052
SMILES:C1CC(C)C2C(C1)C(C)(C)Oc1cc(CCCCC)cc(OC3OC(CO)C(O)C(O)C3O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -13.88
InChIKey:BUKQKEFAGWFPAM-UHFFFAOYSA-N
ID: 90053
SMILES:C1(CCC(=CCc2c(O)cc(CCC)c(C=O)c2O)C)=C(C)CCCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -13.281
InChIKey:AZHDAGCABGLYPE-UHFFFAOYSA-N
ID: 90054
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 90055
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC(=O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 90056
SMILES:c1(CCCC)c(C2C=C(C)CCC2C(C)(C)O)c(O)c(OC)cc1Cl
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.929
CB1 binding score: -12.219
InChIKey:WFJOVEUKWWMRQY-UHFFFAOYSA-N
ID: 90057
SMILES:O1C(=O)CCC1(CC1CC2c3c(cc(CCCCC)cc3OC2)OC2(C)C(C1)CC(O)C(C)(C)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.676
CB1 binding score: -15.929
InChIKey:QXMVPGQTXSCLMS-UHFFFAOYSA-N
ID: 90058
SMILES:C1C(C)C2(Oc3c(c(OC)cc(CCCCC)c3)C2O)C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.495
InChIKey:WJGQTJUZAIIOND-UHFFFAOYSA-N
ID: 90059
SMILES:CC(C)C1=C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.821
InChIKey:UCVSOUIMYBUEIN-UHFFFAOYSA-N
ID: 90060
SMILES:C12(C)CCC1C(C)(C)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -13.897
InChIKey:LAKGOLFWQFGROP-UHFFFAOYSA-N
ID: 90061
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C(O)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.072
InChIKey:DJCKLUPKZRLTPE-UHFFFAOYSA-N
ID: 90062
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.552
InChIKey:IQQWVNYGBXVDNU-UHFFFAOYSA-N
ID: 90063
SMILES:C1(C)=CCCC(C)(C)C2C(c3c(O)cc(CCCCC)cc31)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.288
InChIKey:IRIIFHVKUXOXII-UHFFFAOYSA-N
ID: 90064
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC3(CC4C(C(O)=O)=CCC4C(C)(C)C3)CC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -15.581
InChIKey:QUYOEIWWUHUZIW-UHFFFAOYSA-N
ID: 90065
SMILES:O=Cc1c(O)c2c(cc1CCC(O)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.992
InChIKey:OFDQJIVXYFCDKA-UHFFFAOYSA-N
ID: 90066
SMILES:c1(CCc2ccc(O)cc2)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -16.83
InChIKey:PBEGVXRRRZSVOL-UHFFFAOYSA-N
ID: 90067
SMILES:CCCc1ccc(O)c(C2C=C(C(OC)=O)CCC2C(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.761
InChIKey:CMXJEHWABJRFPV-UHFFFAOYSA-N
ID: 90068
SMILES:C1=CC2C(=C)C(C)(C)C3C2C(c2c(cc(CCCCC)cc2O)O3)C1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -13.687
InChIKey:XNXVXXOUYHUGAK-UHFFFAOYSA-N
ID: 90069
SMILES:C(C1(O)C(C)(C)Oc2c1c(O)cc(CCCCC)c2)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.868
InChIKey:AYRIZTRPIODMNQ-UHFFFAOYSA-N