ID: 112708
SMILES:CC1(C)C2COc3c(c(O)cc(CCCCC)c3)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.132
InChIKey:ZTLOAKWVRBBBAC-UHFFFAOYSA-N
ID: 112709
SMILES:Oc1cc2c(c(O)c1Cc1oc(CCC(=O)OC(C)(C)C)cc1)C1C(CCC(C(=O)O)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.572
CB1 binding score: -15.979
InChIKey:IWHHVIXGTLZICH-UHFFFAOYSA-N
ID: 112710
SMILES:C12C(CC(=C)CCC1C(C)C)Oc1c(c(O)cc(CCCCC)c1)C2CCC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -12.358
InChIKey:CILXLOHJWIFLFW-UHFFFAOYSA-N
ID: 112711
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)c(C=O)cc(CCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.527
InChIKey:JAZQFVAZPZBBQJ-UHFFFAOYSA-N
ID: 112712
SMILES:C1C(C)C(O)(c2c(O)cc(CCC(CC)O)cc2O)C2C(C)(C)C1CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.04
InChIKey:FXUQSADPFPMXKR-UHFFFAOYSA-N
ID: 112713
SMILES:c1(O)c(C2C=C(C)CCC2C(C)=C)c(O)c(C=O)c(OC)c1C(C=C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.931
InChIKey:TXAIOFWEVMBMBE-UHFFFAOYSA-N
ID: 112714
SMILES:C1(C)(C)C2CC=C(C=O)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.255
InChIKey:BGIBNWZALWRTHR-UHFFFAOYSA-N
ID: 112715
SMILES:C(Cc1c2c(cc(CCC(=O)O)c1)OC(C)(C)c1c-2cc(C)cc1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -15.929
InChIKey:DOXBVRRVAAAMOI-UHFFFAOYSA-N
ID: 112716
SMILES:CC(c1cc(O)c2c(c1)OC(C)(C)C1CCC(O)(C)CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.766
InChIKey:JVXDJMUHRLKDIR-UHFFFAOYSA-N
ID: 112717
SMILES:C12=CC3(CC1C1C(C(C)(C)Oc4cc(CCCCC)cc(OC(=O)C)c41)CC2)OC(C)(C)C=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -13.741
InChIKey:MDKBCNTYYDRMPC-UHFFFAOYSA-N
ID: 112718
SMILES:c1c(CCCCC)cc2c(c1O)OC1C(C(C)C)CCC(C)C13C=CC(C)(O2)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -12.458
InChIKey:DIEFZHVSNGISOX-UHFFFAOYSA-N
ID: 112719
SMILES:C1(C)(C)C2CCC(C=O)C1c1c(OC(C)=O)c(OC(=O)C)c(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -14.902
InChIKey:FUXSQDBSSOCPDF-UHFFFAOYSA-N
ID: 112720
SMILES:C1C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC(O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.143
InChIKey:CIVSDEYXXUHBPV-UHFFFAOYSA-N
ID: 112721
SMILES:CC(C12CCC(=C)CCC=C(C)CC1OC(c1c(O)c(O)c(O)cc1CCCCCCC)=C2)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -14.485
InChIKey:QUVCNMIMDLJMMK-UHFFFAOYSA-N
ID: 112722
SMILES:C1(C(C)=C)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(OC(=O)c2cc(O)c(O)cc2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -16.036
InChIKey:WFLKYCOUBBTPFY-UHFFFAOYSA-N
ID: 112723
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 112724
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -16.294
InChIKey:QWRSIZSKOZKJGD-UHFFFAOYSA-N
ID: 112725
SMILES:C(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 112726
SMILES:C(CCCCC)c1cc2c(c(O)c1)C1C(=O)OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.693
InChIKey:YZVUUOCAXYABDV-UHFFFAOYSA-N
ID: 112727
SMILES:CCCc1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 112728
SMILES:C(=O)(C=C(C)C)Oc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -13.766
InChIKey:GFLWJFWLVSRRCB-UHFFFAOYSA-N