ID: 61405
SMILES:OCC1=CC2c3c(cc(C)c(Br)c3O)OC(C)(C)C2CC1Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 387.701
CB1 binding score: -12.748
InChIKey:LIDWDESTMGXAOG-UHFFFAOYSA-N
ID: 61406
SMILES:C1(C)C2CCC(=C)CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.415
InChIKey:JGCNXVTYEBSNPI-UHFFFAOYSA-N
ID: 61407
SMILES:C1(=NO)CC2C(C)(C)Oc3c(c(O)c(CC(C(C)(O)C)O)c(O)c3C)C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.491
CB1 binding score: -11.07
InChIKey:VJKPWIWUZRAVDY-UHFFFAOYSA-N
ID: 61408
SMILES:C(C(C)CO)Cc1c(O)c(C(=O)O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.676
InChIKey:HMSGTFKHFZHGGX-UHFFFAOYSA-N
ID: 61409
SMILES:C(c1cc2c(c(O)c1CC=C(C)C)OC(C)(C)C1C2C=C(C)CC1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -12.638
InChIKey:DNRMBBAOKPPHGX-UHFFFAOYSA-N
ID: 61410
SMILES:C(CC)Cc1cc(O)c2c(c1)OC1(C)CCC3C(CC2O1)C(C)(C)C(O)CC3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.664
InChIKey:VRRFXBXPXJEDJI-UHFFFAOYSA-N
ID: 61411
SMILES:C(C=C(C)C)c1c(O)c(CC=C(C)CCC=C(C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 61412
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 61413
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)cc(CCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.015
InChIKey:CGAYOGUQVMIFPE-UHFFFAOYSA-N
ID: 61414
SMILES:C1C(O)C(C)(C)Oc2c1c(O)cc(CCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 236.311
CB1 binding score: -18.491
InChIKey:VKJOEJPIVLHXOA-UHFFFAOYSA-N
ID: 61415
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C(CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.061
InChIKey:YGECZSOGAIZGAJ-UHFFFAOYSA-N
ID: 61416
SMILES:C1C(C)C2(C)Oc3cc(CCCCC)cc(OC4(C)OC(=O)C(C)=C4)c3C=C2C(C(OC)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.59
CB1 binding score: -12.033
InChIKey:JKRPKMSHHOGUDY-UHFFFAOYSA-N
ID: 61417
SMILES:C(CCCCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -18.138
InChIKey:CUNZWRHOBZASJY-UHFFFAOYSA-N
ID: 61418
SMILES:C1(C)=CCC2C(C1C)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.502
InChIKey:WVANDIGQNFIFCP-UHFFFAOYSA-N
ID: 61419
SMILES:c1(O)cc(CCCCC)cc2c1C1C(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: 61420
SMILES:C(=CCCC(=CCc1c(OC)cc(CCC(O)CC)c(C(O)=O)c1O)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.955
InChIKey:AEXOPMPZFMFZIV-UHFFFAOYSA-N
ID: 61421
SMILES:CCCCCc1c(C(O)C=CC(C)(C)O)c2c(c(-c3cc(O)c(CC=C(C)C)c(O)c3)c1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.844
CB1 binding score: -12.723
InChIKey:CEPNMIHBADKRME-UHFFFAOYSA-N
ID: 61422
SMILES:C1=C(C)CCC2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 61423
SMILES:C1C2(C)CC3(c4c(cc(CCCCC)cc4O)OC3)CC2C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.992
InChIKey:NHKPTWFLLWSBJU-UHFFFAOYSA-N
ID: 61424
SMILES:CCC(C(=O)c1c(O)cc(O)c2c1OC(C)(C)C1CCC(C)(O)CC21)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.912
InChIKey:FVBZOAKTRQYEBD-UHFFFAOYSA-N
ID: 61425
SMILES:C1CC2(C(C)(C)Oc3c2c(O)cc(CCC(O)=O)c3)C2=CCC(C)C(C)(CCC(Cc3cc(O)ccc3O)C)C12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 562.747
CB1 binding score: -15.011
InChIKey:FVJDIPFRAAKIOQ-UHFFFAOYSA-N