ID: 92485
SMILES:C(Oc1c(O)c2c(c(O)c1O)C1C(C(C)(C)O2)CCC(C)=C1)(=O)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -13.249
InChIKey:PCNQPYZRJTXREH-UHFFFAOYSA-N
ID: 92486
SMILES:CC(C1C(c2c(O)cc3c(c2O)C=CC(C)(CCC=C(CO)C)O3)C(O)C(O)C(OC)C1)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.582
CB1 binding score: -15.12
InChIKey:GBBMTKXXQOHKBZ-UHFFFAOYSA-N
ID: 92487
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCCO)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.244
InChIKey:PKMOAJVDILUOPD-UHFFFAOYSA-N
ID: 92488
SMILES:CC(CC(=O)c1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.14
InChIKey:IBHIRSNESUJTMC-UHFFFAOYSA-N
ID: 92489
SMILES:C(C)(=O)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.943
InChIKey:CMKPMOWKXOMQAZ-UHFFFAOYSA-N
ID: 92490
SMILES:COc1c2c(cc(CCCCC)c1)OC1C(C)C3(OC(C4CCC(C)C(CO)C43)(C)O1)C2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -14.798
InChIKey:GCLHGGHQDVSHLV-UHFFFAOYSA-N
ID: 92491
SMILES:BrCC1(CCC=C(C)C)Cc2c(cc(CNC)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.288
CB1 binding score: -13.522
InChIKey:FRUNFVHZYKNSBA-UHFFFAOYSA-N
ID: 92492
SMILES:C(CC)Cc1cc(O)c2c(c1)OC1(C)CCC3C(CC3(C)C)C1(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.198
InChIKey:WXVXLNKJGKJQPO-UHFFFAOYSA-N
ID: 92493
SMILES:C(C1(C)C2C(C)(CCC1C(C)C)Oc1c(c(O)cc(CCCCCO)c1)C2)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.21
InChIKey:FFYPNVITMUYTPS-UHFFFAOYSA-N
ID: 92494
SMILES:C1C=C(C)C2=Cc3c(O)cc(CCCCC)cc3OC2(C)CC=CC(C)(C)CC=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -16.464
InChIKey:FGVRDYZCMVMIMB-UHFFFAOYSA-N
ID: 92495
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(CO)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 92496
SMILES:c12cc(CCCCC)cc(O)c1OC1(C)C(C2)C(C(C)C)=CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.946
InChIKey:ZGSYJJNYMNLQHN-UHFFFAOYSA-N
ID: 92497
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 92498
SMILES:C12C(C)(C)CC(=O)C(Oc3ccc(CCCC)cc3-c3c(CC=C(C)C)c(O)cc4c3C1(CO)CC(C(=C)C)OO4)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 588.741
CB1 binding score: -17.058
InChIKey:HTWDOVHHBSRIIW-UHFFFAOYSA-N
ID: 92499
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 92500
SMILES:C1c2c(ccc(O)c2)OC2C1CC(C)=C(CCC(C)(C=CC=C(C)C)O)C(O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -12.379
InChIKey:YTDQZCOXDNBNCJ-UHFFFAOYSA-N
ID: 92501
SMILES:C(=C(C)C)CCC1(C)Oc2c(c(O)cc(C(C(C)CC)=O)c2O)C2CC(C)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.103
InChIKey:ZSZSGPHGKOWFRE-UHFFFAOYSA-N
ID: 92502
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(CO)O2)CCC(=C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.732
InChIKey:CHNFLWZWRNBJTA-UHFFFAOYSA-N
ID: 92503
SMILES:O1c2cc(CCN(C)C)ccc2CC2C=C(C)CCC2C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -17.181
InChIKey:PJHVJGMYNRZVAA-UHFFFAOYSA-N
ID: 92504
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 92505
SMILES:c1(O)cc(CCCCC)cc2c1C1C3C(C(C)(CO2)O3)CCC(COC(C)=O)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -17.792
InChIKey:SDWBSLBNSFZGCU-UHFFFAOYSA-N