ID: 80536
SMILES:C(C1C(C)(C)Oc2c1c(O)cc(CCCCC)c2O)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -14.529
InChIKey:MUSWWGQVTOLKHJ-UHFFFAOYSA-N
ID: 80537
SMILES:c12c(cc(O)c(Cc3c(O)c(O)cc(CCCCC)c3)c1O)C1C(C(O)C(C)(C)O2)C(C)(C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.578
CB1 binding score: -14.492
InChIKey:WSDPDNQABQQECC-UHFFFAOYSA-N
ID: 80538
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.691
InChIKey:RDLVEYAULHYSIG-UHFFFAOYSA-N
ID: 80539
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -18.138
InChIKey:CUNZWRHOBZASJY-UHFFFAOYSA-N
ID: 80540
SMILES:C(CC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O)CC(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -17.011
InChIKey:UNZYAXFMIZROQJ-UHFFFAOYSA-N
ID: 80541
SMILES:C1CCC(C)(C(CC(=O)CC(=CCc2cc(OC)cc(C)c2O)C)C)OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.032
InChIKey:ZSPIGBFJXXHYIT-UHFFFAOYSA-N
ID: 80542
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C(C)=C)CCC2(CO)C1C[N+](C)(CCCCCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.788
CB1 binding score: -16.998
InChIKey:CWIUTIYZFXTHOU-UHFFFAOYSA-O
ID: 80543
SMILES:C(c1c(CCCCC)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.41
InChIKey:CJQFHQYQTSDLFD-UHFFFAOYSA-N
ID: 80544
SMILES:c1(CC2C(C)(C=C)OC(C)(C)C2)c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -14.254
InChIKey:XLZGINPUCHOKQE-UHFFFAOYSA-N
ID: 80545
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(CCC=C1C3C(OC1=O)C(O)(C)CC3)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -17.329
InChIKey:USYAPZGYDIZJRG-UHFFFAOYSA-N
ID: 80546
SMILES:C(C(=O)C1(C)C(c2c(O)c(C(=O)O)c(CCCC)cc2O)CC(C(C)=C)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -16.044
InChIKey:NSTSZZHTOJZVMU-UHFFFAOYSA-N
ID: 80547
SMILES:C(CCCCCCCc1cc2c(c(O)c1)C1C(CC=C(C)C)C3(CCC(C)C=C3O)OC(O)(C)CC1O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.758
CB1 binding score: -14.446
InChIKey:YXRCGYMYZHLTCI-UHFFFAOYSA-N
ID: 80548
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 80549
SMILES:C=C(C1C2C(C(=O)CC1)C(C(=O)OCCc1ccc(O)cc1)C1(C)CC1c1c2c(O)cc(CCCCC)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.705
CB1 binding score: -15.434
InChIKey:JVNXILFKRHVSPC-UHFFFAOYSA-N
ID: 80550
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 80551
SMILES:CC(C=C)(O)CCC1(C(=O)O)C=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -16.053
InChIKey:DYCFGBYBYJHCMG-UHFFFAOYSA-N
ID: 80552
SMILES:COc1c(OC)c2c(c(CCCCC)c1)OC1(C)CC2C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.03
InChIKey:IZMKNRVUMPMVND-UHFFFAOYSA-N
ID: 80553
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -17.095
InChIKey:HFBZIOXWNGGNFX-UHFFFAOYSA-N
ID: 80554
SMILES:c12cc(CCCCC)cc(O)c1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.581
InChIKey:WTPLHNOHHJDOPW-UHFFFAOYSA-N
ID: 80555
SMILES:O1c2c(c(O)cc(O)c2)C2C(C(C)=C)CCC(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -15.203
InChIKey:MLUNEADPXSZOPY-UHFFFAOYSA-N
ID: 80556
SMILES:C(Cc1cc(OC)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.163
InChIKey:LGOHASGDRZGNMH-UHFFFAOYSA-N