ID: 97084
SMILES:c1c(CCCCC)cc2c(c1OC)OC(C)(C)C1CC=C(C(OC)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.308
InChIKey:YZEOPCNKLKSMLM-UHFFFAOYSA-N
ID: 97085
SMILES:C(C)(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.559
InChIKey:NEOMHYIKJUAVNS-UHFFFAOYSA-N
ID: 97086
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 97087
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C=Cc1ccc(O)cc1)C1C(C)(CCC1C(=C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.631
CB1 binding score: -14.762
InChIKey:QOBOHDYIVBECON-UHFFFAOYSA-N
ID: 97088
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1=C(C2=O)OC(C(O)(C)C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.123
InChIKey:ACMALKWQSLNSGH-UHFFFAOYSA-N
ID: 97089
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(C)C1C2C(O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.692
InChIKey:SNPCQPJTVQTRGI-UHFFFAOYSA-N
ID: 97090
SMILES:c1c(C(=O)C=C(C)C)c(C=O)c(O)c2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.379
InChIKey:IAMSPEATVCRRJH-UHFFFAOYSA-N
ID: 97091
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N
ID: 97092
SMILES:COc1cc2c(cc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.764
InChIKey:NRRZXOLZVDIGDT-UHFFFAOYSA-N
ID: 97093
SMILES:O1C(=O)c2c(cc(CCCCC)cc2O)OC1C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.981
InChIKey:UWHPGUDSKYQUQB-UHFFFAOYSA-N
ID: 97094
SMILES:c12c(c(CC=C(CCC=C(C)C)CO)ccc1O)OC(C)(C)C(CC=CC)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.474
InChIKey:DKQJWDUWOICYMD-UHFFFAOYSA-N
ID: 97095
SMILES:C1(C=C)(C)C=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -17.346
InChIKey:FTHTUYWWSHIISZ-UHFFFAOYSA-N
ID: 97096
SMILES:C1C(C)C(=O)C(C=C(C)C)c2c(O)cc(CCC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.194
InChIKey:IFZCECCRCCXRAT-UHFFFAOYSA-N
ID: 97097
SMILES:C1(CC(O)C(=CCc2c(O)c(C)cc(O)c2)C)=C(C)CCC1C(=CCCC(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.168
InChIKey:UPEOUFXUHRMSJA-UHFFFAOYSA-N
ID: 97098
SMILES:C(CC)CCCc1cc2c(cc1O)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.779
InChIKey:NQIWSVQOOBFNFX-UHFFFAOYSA-N
ID: 97099
SMILES:C(C(=O)c1c(O)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1)CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -13.715
InChIKey:TWHQJNGNBQNCIY-UHFFFAOYSA-N
ID: 97100
SMILES:Oc1c2c(c(CC=C(C)CCC=C(C)C)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.015
InChIKey:GZNOJTAHVQCGKC-UHFFFAOYSA-N
ID: 97101
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 97102
SMILES:C=C(C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(COC(=O)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.506
InChIKey:ILJBZYIZTNTWIK-UHFFFAOYSA-N
ID: 97103
SMILES:C1C2C3(C(C)C1)c1c(cc(CCCCC)cc1O)OC2(C)CCC3C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.643
InChIKey:YFCHZRKQCZDEIR-UHFFFAOYSA-N
ID: 97104
SMILES:CC1(C)C2C(c3c(cc(CCCCC)cc3O)O1)C(O)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N