ID: 104896
SMILES:O1C23Oc4cc(C)cc(O)c4C(CC(C)=CCC2(C)CC1C=C(C)C)C(=O)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -12.686
InChIKey:FTVZSYVFWQDZLX-UHFFFAOYSA-N
ID: 104897
SMILES:C(CCCC=CCCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1)(=O)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.288
InChIKey:PHXOQTNIJDHMOO-UHFFFAOYSA-N
ID: 104898
SMILES:Oc1cc(CCCCC)cc2c1C1C=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: 104899
SMILES:CC(O)(C)C1(O)CCC(C)=CCCC2(C)Oc3c(c(OC)cc(CCCCC)c3)CC2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -16.613
InChIKey:IJFBOBGRIBINLE-UHFFFAOYSA-N
ID: 104900
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 104901
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1cc3c(cc12)C(=O)CC3C(=C)C)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.469
CB1 binding score: -12.853
InChIKey:ZJWMFDHOPANYHD-UHFFFAOYSA-N
ID: 104902
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)(O)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.296
InChIKey:FZAGTOJLWTUWJG-UHFFFAOYSA-N
ID: 104903
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(O)c1C)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.029
InChIKey:RORUGVXWFDRHOM-UHFFFAOYSA-N
ID: 104904
SMILES:c12c(c(C=O)ccc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -16.993
InChIKey:FQTFNXFDBKJYTD-UHFFFAOYSA-N
ID: 104905
SMILES:Oc1c(CC(OCC)=O)cc(O)c(C2C=C(C)CCC2C(=C)C)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.254
InChIKey:GVZOUIPWKODVJF-UHFFFAOYSA-N
ID: 104906
SMILES:C1(CCC=C(C)C)=C2C3(C(C)CC1)CC(C(C)=C)C2C(=O)c1c(O)cc2c(c1O3)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.76
CB1 binding score: -14.221
InChIKey:KLMGSINEVSFMMD-UHFFFAOYSA-N
ID: 104907
SMILES:CC1(C)Oc2c(ccc(CC[N+](C)(CCCCCCCC)C)c2)CC1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.578
CB1 binding score: -15.578
InChIKey:MQWSPHKGOSPDJG-UHFFFAOYSA-N
ID: 104908
SMILES:c1(C(CC)C)c(O)c(OC)c(O)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.82
InChIKey:XLMIZCTUOUGZJS-UHFFFAOYSA-N
ID: 104909
SMILES:C1(C)(C)OC23Cc4c(cc(O)cc4O)C(=O)OC2CC(O)(C1(C)CCC=C(C)C)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -12.185
InChIKey:REMCHVADVPOLFW-UHFFFAOYSA-N
ID: 104910
SMILES:C12=C(C)CCC(CC3C(C)CC4c5c(O)cc(CCCCC)cc5OCC43CC1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -15.385
InChIKey:XPBKFJBIXBALGM-UHFFFAOYSA-N
ID: 104911
SMILES:CC(O)(C)C1C(c2cc(CCCCC)cc(O)c2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.412
InChIKey:TZWHOFYMKTZLSH-UHFFFAOYSA-N
ID: 104912
SMILES:c1(C(CC=C(C)C(N=C(NC)O)C)=O)c(O)c(C2C=C(C)CCC2C(C)=C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.557
CB1 binding score: -14.982
InChIKey:AMKASRNGKAKRRR-UHFFFAOYSA-N
ID: 104913
SMILES:C12OC1(C)CCC=C(C)CCC(C(C)=C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.078
InChIKey:KRZSVZYKLHEGNQ-UHFFFAOYSA-N
ID: 104914
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 104915
SMILES:c1(O)cc(O)cc(C)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 104916
SMILES:C(CC(C)C)Cc1ccc(C2(C)OC(C(=C)C)CC2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.491
InChIKey:RVMIUBRBXILUGQ-UHFFFAOYSA-N